COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
FULL DB
Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )
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STL537423
Synonyms: (12aS)-2-(1-benzylpiperidin-4-yl)-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1N(CC(=O)N2[C@H]1Cc1c(C2c2ccc(cc2)C(C)C)[nH]c2c1cccc2)C1CCN(CC1)Cc1ccccc1
STL537424
Synonyms: 4-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(6-methylheptan-2-yl)benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccc(cc1)C(=O)NC(CCCC(C)C)C
STL537425
Synonyms: (12bS)-2-(3-methoxybenzyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)CN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537426
Synonyms: (5R,7S)-2-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-5,7-diethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol
Smiles: CC[C@]12CN3C[C@@]([C@H]2O)(CN(C1)C3C1CCOC(C1)(C)C)CC
STL537427
Synonyms: (2S)-{[(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]amino}(4-hydroxyphenyl)ethanoicacid
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2C)O)N[C@@H](c1ccc(cc1)O)C(=O)O
STL537428
Synonyms: N-[3-(3,4-dimethoxyphenyl)-3-{[3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]amino}propanoyl]glycine
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NC(c1ccc(c(c1)OC)OC)CC(=O)NCC(=O)O
STL537429
Synonyms: 3-{2-[(6R,6aR,13S,13aS)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-yl]-2-oxoethyl}-7-hydroxy-4-methyl-2H-chromen-2-one
Smiles: Oc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31
STL537430
Synonyms: N-benzyl-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCc1ccccc1
STL537431
Synonyms: (1S,5S)-N-[(2S)-1-[(3,5-dimethylphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1cc(C)cc(c1)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL537432
Synonyms: 7-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-4-(4-methoxyphenyl)-8-methyl-2H-chromen-2-one
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc(c2C)OCC(=O)N1CCC2(C(C1)CCCC2)O
STL537433
Synonyms: (12aS)-2-benzyl-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1
STL537434
Synonyms: N-cyclohexyl-1-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-5-oxo-L-prolinamide
Smiles: COc1c(OC)ccc2c1C(=O)OC2N1C(=O)CC[C@H]1C(=O)NC1CCCCC1
STL537435
Synonyms: methyl4-[(12aS)-2-(2-methoxyethyl)-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-6-yl]benzoate
Smiles: COCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C(=O)OC)[nH]c2c1cccc2
STL537436
Synonyms: 6-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,5,9-trimethyl-3-phenyl-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1c1ccccc1)C
STL537437
Synonyms: 1-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-5-oxo-N-(2-phenylethyl)-L-prolinamide
Smiles: COc1c(OC)ccc2c1C(=O)OC2N1C(=O)CC[C@H]1C(=O)NCCc1ccccc1
STL537438
Synonyms: (2E)-1-[1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Smiles: CCOc1ccccc1C1N(CCC2(C1CCCC2)O)C(=O)/C=C/c1cc(OC)c(c(c1)OC)OC
STL537439
Synonyms: (11bS)-2-hexyl-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: CCCCCCN1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537440
Synonyms: (12aS)-2-butyl-6-(3-chlorophenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)Cl)[nH]c2c1cccc2
STL537442
Synonyms: 1-[(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]piperidine-3-carboxylicacid
Smiles: OC(=O)C1CCCN(C1)C(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C
STL537443
Synonyms: N-({1-[1-(tert-butoxycarbonyl)-L-prolyl]piperidin-4-yl}carbonyl)-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C
STL537444
Synonyms: 4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-pentylbenzamide
Smiles: CCCCCNC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537445
Synonyms: N-[2-(4-methoxyphenyl)ethyl]-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc(cc1)CCNC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537446
Synonyms: 3-benzyl-6-chloro-7-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-4-methyl-2H-chromen-2-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)COc1cc2oc(=O)c(c(c2cc1Cl)C)Cc1ccccc1
STL537447
Synonyms: (2S)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(6-methylheptan-2-yl)propanamide
Smiles: CC(CCCC(NC(=O)[C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C)C)C
STL537448
Synonyms: (12aS)-6-(2-ethoxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1c[nH]c2c1cccc2
STL537449
Synonyms: (3S,11E)-14-[(4-ethenylbenzyl)oxy]-16-hydroxy-3-methyl-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione
Smiles: C=Cc1ccc(cc1)COc1cc2/C=C/CCCC(=O)CCC[C@@H](OC(=O)c2c(c1)O)C
STL537450
Synonyms: 5-[1-(2,5-dimethoxyphenyl)-1H-tetrazol-5-yl]-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline
Smiles: COc1ccc(c(c1)n1nnnc1C1N(C)CCc2c1c(OC)c1c(c2)OCO1)OC
STL537451
Synonyms: (12aS)-2-cyclopropyl-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CC1
STL537452
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-1-[(4-ethylphenyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl}carbamate
Smiles: CCc1ccc(cc1)NC(=O)[C@@H](NC(=O)C1CCN(CC1)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C
STL537453
Synonyms: (3aS,6R,7R,7aS)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(1H-indol-3-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: O=C([C@H]1[C@@H]2C=C[C@@]3([C@H]1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2)Nc1ccc2c(c1)OCCO2
STL537454
Synonyms: 2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]-N-(4-phenylbutan-2-yl)acetamide
Smiles: CC(NC(=O)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1)CCc1ccccc1
STL537455
Synonyms: (12aS)-2-cyclopentyl-6-(4-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCC1
STL537456
Synonyms: 4-ethyl-8-methyl-2-oxo-2H-chromen-7-ylN-[(benzyloxy)carbonyl]norleucinate
Smiles: CCCCC(C(=O)Oc1ccc2c(c1C)oc(=O)cc2CC)NC(=O)OCc1ccccc1
STL537457
Synonyms: (12aS)-6-(3-bromophenyl)-2-cyclopropyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Brc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CC1
STL537458
Synonyms: (12bR)-2-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1c(cccc1OC)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537459
Synonyms: (12aS)-2-[2-(4-fluorophenyl)ethyl]-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccc(cc1)F
STL537460
Synonyms: (1S,5S)-N-{(2S)-1-[(4-bromo-2-fluorophenyl)amino]-3-methyl-1-oxobutan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: Brc1ccc(c(c1)F)NC(=O)[C@H](C(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL537461
Synonyms: 7-[(4-chlorobenzyl)oxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4-methyl-2H-chromen-2-one
Smiles: Clc1ccc(cc1)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCC2(C(C1)CCCC2)O
STL537462
Synonyms: (12aS)-6-(2,4-dimethoxyphenyl)-2-(2-methylpropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(c(c1)OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CC(C)C
STL537463
Synonyms: (12aS)-6-(3-methoxyphenyl)-2-(3-methylbutyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCC(C)C
STL537464
Synonyms: tert-butyl[(2S)-4-methyl-1-(4-{[(2S)-3-methyl-1-oxo-1-{[4-(propan-2-yl)phenyl]amino}butan-2-yl]carbamoyl}piperidin-1-yl)-1-oxopentan-2-yl]carbamate
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)C(C)C)C(C)C)NC(=O)OC(C)(C)C)C
STL537465
Synonyms: (2E)-1-[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-3-(4-methoxyphenyl)prop-2-en-1-one
Smiles: COc1ccc(cc1)/C=C/C(=O)N1CCC2(C(C1c1ccccc1OC)CCCC2)O
STL537466
Synonyms: N-[({[(3E,8xi,9xi,14xi)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetyl]glutamicacid
Smiles: O=C(NC(C(=O)O)CCC(=O)O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2O)C)C
STL537467
Synonyms: 2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-pentylbenzamide
Smiles: CCCCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL537468
Synonyms: (2E)-N-(4-butoxyphenyl)-2-{[(12aS)-1,4-dioxo-3,4,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-2(1H)-yl]imino}ethanamide
Smiles: CCCCOc1ccc(cc1)NC(=O)/C=N/N1CC(=O)N2[C@H](C1=O)Cc1c(C2)[nH]c2c1cccc2
STL537469
Synonyms: (3E,8xi)-3-[(4-methylpiperazin-1-yl)imino]carda-14,16,20(22)-trienolide
Smiles: CN1CCN(CC1)/N=C/1\CC[C@]2(C(C1)CCC1[C@@H]2CC[C@]2(C1=CC=C2C1=CC(=O)OC1)C)C
STL537470
Synonyms: N-heptyl-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCCCCNC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537471
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-leucyl]piperidin-4-yl}carbonyl)-L-tryptophan
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)NC(=O)OC(C)(C)C)C
STL537472
Synonyms: (12aS)-6-(2,4-dimethoxyphenyl)-2-(4-methylbenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(OC)ccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(cc1)C
STL537473
Synonyms: N-(2-fluorobenzyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1ccccc1F
STL537474
Synonyms: 4-[3-(1H-indol-3-yl)-2,5-dioxopyrrolidin-1-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)CC(C1=O)c1c[nH]c2c1cccc2
STL537475
Synonyms: N~2~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-(6-methylheptan-2-yl)glycinamide
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)NCC(=O)NC(CCCC(C)C)C
STL537476
Synonyms: (12aS)-2-cyclohexyl-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(C2CCCCC2)C(=O)[C@H]2N1C(c1ccccc1C)c1c(C2)c2c([nH]1)cccc2
STL537477
Synonyms: (12aS)-2-benzyl-6-(4-chlorophenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1
STL537478
Synonyms: N-[4-(furan-2-yl)butan-2-yl]-2-{[3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}acetamide
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCC(=O)NC(CCc1ccco1)C
STL537479
Synonyms: (12bR)-12b-methyl-2-{[(E)-(3-methylphenyl)methylidene]amino}-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Cc1cccc(c1)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537480
Synonyms: (12aS)-2-[2-(3,4-dimethoxyphenyl)ethyl]-6-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(CCN2CC(=O)N3[C@H](C2=O)Cc2c(C3C)[nH]c3c2cccc3)ccc1OC
STL537481
Synonyms: (12aS)-2-(4,4-diethoxybutyl)-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOC(CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OC)[nH]c2c1cccc2)OCC
STL537482
Synonyms: N-[1-(1H-indol-3-yl)propan-2-yl]-2-(4,8,8-trimethyl-2-oxo-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl)acetamide
Smiles: CC(Cc1c[nH]c2c1cccc2)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(C)C
STL537483
Synonyms: N-[2-(4-chlorophenyl)ethyl]-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: Clc1ccc(cc1)CCNC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537484
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(NC1CCOC(C1)(C)C)COc1cc(O)c2c(c1)OC(CC2=O)(C)C
STL537485
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCCCn1cncc1
STL537486
Synonyms: methyl4,5-dimethoxy-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzoate
Smiles: COC(=O)c1cc(OC)c(cc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)OC
STL537487
Synonyms: (12aS)-2-cyclohexyl-6-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(C2CCCCC2)C(=O)[C@H]2N1C(C)c1c(C2)c2c([nH]1)cccc2
STL537488
Synonyms: N-(4-hydroxy-1,1-dioxidotetrahydrothiophen-3-yl)-2-(3,4,9-trimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c1occ(c1c(c2)C)C)NC1CS(=O)(=O)CC1O
STL537489
Synonyms: (2S)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(4-phenylbutan-2-yl)propanamide
Smiles: CC(NC(=O)[C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C)CCc1ccccc1
STL537490
Synonyms: 4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(4-phenoxyphenyl)benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)Nc1ccc(cc1)Oc1ccccc1
STL537491
Synonyms: 6-{2-[(6R,6aR,13S,13aS)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-yl]-2-oxoethyl}-2,3,5-trimethyl-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
STL537492
Synonyms: (11bS)-2-(2,4-dichlorophenyl)-8-methoxy-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccc(cc1Cl)Cl
STL537493
Synonyms: N-(4-methoxybenzyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc(cc1)CNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537494
Synonyms: (12bR)-12b-methyl-2-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: CC(c1ccc(cc1)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C
STL537495
Synonyms: (12bS)-2-(2,2-dimethoxyethyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COC(CN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)OC
STL537496
Synonyms: 1-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-5-oxo-N-(4-phenylbutan-2-yl)-L-prolinamide
Smiles: COc1c(OC)ccc2c1C(=O)OC2N1C(=O)CC[C@H]1C(=O)NC(CCc1ccccc1)C
STL537497
Synonyms: 2-chloro-3-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)COc1cc2oc(=O)c3c(c2cc1Cl)CCCC3
STL537498
Synonyms: (12bR)-2-{[(E)-(3-chlorophenyl)methylidene]amino}-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1cccc(c1)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537499
Synonyms: (2S)-4-(methylsulfinyl)-2-{[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}butanoicacid
Smiles: O=C(N[C@H](C(=O)O)CCS(=O)C)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
STL537500
Synonyms: N-({[(2Z)-2-(3-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-D-phenylalanine
Smiles: COc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)N[C@@H](C(=O)O)Cc1ccccc1
STL537501
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-[(4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetamide
Smiles: O=C(NC1CCOC(C1)(C)C)COc1cc2OC(C)(C)CCc2c2c1c(C)cc(=O)o2
STL537502
Synonyms: (12aS)-2-cycloheptyl-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCCC1
STL537503
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-valyl]piperidin-4-yl}carbonyl)glycine
Smiles: CC([C@@H](C(=O)N1CCC(CC1)C(=O)NCC(=O)O)NC(=O)OC(C)(C)C)C
STL537504
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-phenylalanyl]piperidin-4-yl}carbonyl)-L-tryptophan
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)Cc1ccccc1
STL537505
Synonyms: (12aS)-6-(4-ethoxy-3-methoxyphenyl)-2-pentyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(c(c2)OC)OCC)[nH]c2c1cccc2
STL537506
Synonyms: (12aS)-6-phenyl-2-{[(E)-pyridin-4-ylmethylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1N(/N=C/c2ccncc2)CC(=O)N2[C@H]1Cc1c(C2c2ccccc2)[nH]c2c1cccc2
STL537507
Synonyms: N-[3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-L-phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C
STL537509
Synonyms: methyl1-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-5-oxo-L-prolyl-D-tryptophanate
Smiles: COC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]1CCC(=O)N1C1OC(=O)c2c1ccc(c2OC)OC
STL537510
Synonyms: (12aS)-2-(4-fluorobenzyl)-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(cc1)F
STL537512
Synonyms: (12aS)-2-benzyl-6-(2,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(OC)ccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1
STL537513
Synonyms: (2S)-N-[2-(2,4-dichlorophenyl)ethyl]-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamide
Smiles: Clc1ccc(c(c1)Cl)CCNC(=O)[C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C
STL537514
Synonyms: (1S,5S)-3-{[1-(phenylsulfonyl)piperidin-4-yl]carbonyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C1CCN(CC1)S(=O)(=O)c1ccccc1
STL537515
Synonyms: methyl2-(7-methoxy-8-methyl-2-oxo-2H-chromen-4-yl)-3-phenylpropanoate
Smiles: COC(=O)C(c1cc(=O)oc2c1ccc(c2C)OC)Cc1ccccc1
STL537516
Synonyms: 2-(1,3-dimethyl-2,4,6-trioxo-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)CC1C(=O)Nc3c1c(=O)n(c(=O)n3C)C)c[nH]2
STL537517
Synonyms: (12bS)-2-cycloheptyl-9-methoxy-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)C1CCCCCC1
STL537518
Synonyms: 2-{[(5-methyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetyl]amino}butanoicacid
Smiles: CCC(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1
STL537519
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-tryptophyl]piperidin-4-yl}carbonyl)-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)OC(C)(C)C)C
STL537520
Synonyms: (12bR)-12b-methyl-2-{[(E)-pyridin-3-ylmethylidene]amino}-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(/N=C/c2cccnc2)C(=O)[C@@]2(N1CCc1c2[nH]c2c1cccc2)C
STL537521
Synonyms: methylN-{[4-(pyridin-3-yl)-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}glycinate
Smiles: COC(=O)CNC(=O)N1CCc2c(C1c1cccnc1)[nH]cn2
STL537522
Synonyms: (12aS)-2-cyclohexyl-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCC1
STL537523
Synonyms: (2S)-N-(2,2-diphenylethyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamide
Smiles: O=C([C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C)NCC(c1ccccc1)c1ccccc1
STL537524
Synonyms: (12aS)-2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1OC)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2C)[nH]c2c1cccc2
STL537525
Synonyms: N-(2-methoxyethyl)-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL537526
Synonyms: (12aS)-6-(3,4-dimethoxyphenyl)-2-(3-methoxypropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(c(c2)OC)OC)[nH]c2c1cccc2
STL537528
Synonyms: (12aS)-2-(4-chlorobenzyl)-6-(4-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Cc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(cc1)Cl
STL537529
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-1-[(4-fluorophenyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)F)C(C)C)NC(=O)OC(C)(C)C
STL537530
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-3-methyl-1-[(4-methylbenzyl)amino]-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl}carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)C)C(C)C)Cc1ccccc1
STL537531
Synonyms: (12bS)-9-methoxy-2-[2-(4-methoxyphenyl)ethyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL537532
Synonyms: (2E)-1-[1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-3-phenylprop-2-en-1-one
Smiles: COc1ccc(c(c1)C1N(CCC2(C1CCCC2)O)C(=O)/C=C/c1ccccc1)OC
STL537533
Synonyms: N-butyl-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCNC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537534
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-1-[(4-fluorophenyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl}carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)F)C)Cc1ccccc1
STL537535
Synonyms: N-(6-methylheptan-2-yl)-2-[(9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-7-yl)oxy]acetamide
Smiles: CC(CCCC(NC(=O)COc1ccc2c(c1)c(=O)n1c(n2)CCC1)C)C
STL537536
Synonyms: (12aS)-2-[3-(dimethylamino)propyl]-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCN(C)C
STL537537
Synonyms: (12aS)-2-cyclopropyl-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(C2CC2)C(=O)[C@H]2N1C(c1ccccc1C)c1c(C2)c2c([nH]1)cccc2
STL537538
Synonyms: (12bS)-2-[2-(4-chlorophenyl)ethyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(cc1)CCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537539
Synonyms: (12aS)-6-methyl-2-[3-(morpholin-4-yl)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1N(CCCN2CCOCC2)CC(=O)N2[C@H]1Cc1c(C2C)[nH]c2c1cccc2
STL537540
Synonyms: (12bS)-2-(2-fluorobenzyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Fc1ccccc1CN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537541
Synonyms: N-[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]norvaline
Smiles: CCCC(C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
STL537542
Synonyms: 7-[(3,4-dichlorobenzyl)oxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4,8-dimethyl-2H-chromen-2-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)ccc(c2C)OCc1ccc(c(c1)Cl)Cl
STL537543
Synonyms: (11bS)-2-[4-chloro-2-(trifluoromethyl)phenyl]-8-methoxy-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccc(cc1C(F)(F)F)Cl
STL537544
Synonyms: (12aS)-6-(2,3-dimethoxyphenyl)-2-(3-methoxypropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2OC)OC)[nH]c2c1cccc2
STL537545
Synonyms: methyl2-(7,8-dimethoxy-2-oxo-2H-chromen-4-yl)-3-phenylpropanoate
Smiles: COC(=O)C(c1cc(=O)oc2c1ccc(c2OC)OC)Cc1ccccc1
STL537546
Synonyms: (3aR,5S,5aR,8aS,8bR)-2,2,7,7-tetramethyl-N-[(1-pentyl-1H-benzimidazol-2-yl)methyl]tetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide(non-preferredname)
Smiles: CCCCCn1c(CNC(=O)[C@H]2O[C@@H]3OC(O[C@@H]3[C@@H]3[C@H]2OC(O3)(C)C)(C)C)nc2c1cccc2
STL537547
Synonyms: N-cyclohexyl-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NC1CCCCC1
STL537548
Synonyms: (12aS)-2-(4,4-diethoxybutyl)-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOC(CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OCC)[nH]c2c1cccc2)OCC
STL537549
Synonyms: N-(4-oxo-4-{[(8xi,9xi,14xi)-3-oxoandrost-4-en-17-yl]oxy}butanoyl)threonine
Smiles: O=C(NC(C(=O)O)C(O)C)CCC(=O)OC1CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C
STL537550
Synonyms: 2-{[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}butanoicacid
Smiles: CCC(C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
STL537551
Synonyms: S-benzyl-N-[(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-D-cysteine
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)N[C@@H](C(=O)O)CSCc1ccccc1
STL537552
Synonyms: N-{2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}-5-hydroxytryptophan
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)c(c2C)C)C)NC(C(=O)O)Cc1c[nH]c2c1cc(O)cc2
STL537553
Synonyms: 1-{[(2-oxo-2H-chromen-7-yl)oxy]acetyl}piperidine-3-carboxylicacid
Smiles: OC(=O)C1CCCN(C1)C(=O)COc1ccc2c(c1)oc(=O)cc2
STL537554
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(octan-3-yl)benzamide
Smiles: CCCCCC(NC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)CC
STL537555
Synonyms: N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)-2-[(3,4,8,8-tetramethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)COc1cc2OC(C)(C)CCc2c2c1c(C)c(c(=O)o2)C
STL537557
Synonyms: pentyl(3aS,6R,7aR)-2-(naphthalen-1-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Smiles: CCCCCOC(=O)C1[C@@H]2C=C[C@@]3([C@@H]1C(=O)N(C3)c1cccc3c1cccc3)O2
STL537558
Synonyms: N-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoyl]-D-methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)O
STL537559
Synonyms: 7-[(2,4-dichlorobenzyl)oxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4-methyl-2H-chromen-2-one
Smiles: Clc1ccc(c(c1)Cl)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCC2(C(C1)CCCC2)O
STL537560
Synonyms: (12aS)-2-(3-chlorobenzyl)-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1cccc(c1)Cl
STL537561
Synonyms: (12aS)-2-[2-(4-fluorophenyl)ethyl]-6-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Fc1ccc(cc1)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2CCc2ccccc2)[nH]c2c1cccc2
STL537562
Synonyms: (1'R,2'R)-1'-acetyl-2'-(2,4-dimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1)OC)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL537563
Synonyms: 2-(2,6-dimethylphenoxy)-N'-[(3E)-2-oxo-1-{[(1R,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-1,2-dihydro-3H-indol-3-ylidene]acetohydrazide
Smiles: O=C(COc1c(C)cccc1C)N/N=C\1/C(=O)N(c2c1cccc2)CN1C[C@@H]2C[C@H](C1)c1n(C2)c(=O)ccc1
STL537564
Synonyms: N~2~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-(pyridin-3-ylmethyl)-L-valinamide
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)NCc1cccnc1)C(C)C
STL537565
Synonyms: 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C1N(CCCn2cncc2)C(=O)C(=C1C(=O)C)O
STL537566
Synonyms: (12aS)-2-(1,3-benzodioxol-5-ylmethyl)-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc2c(c1)OCO2
STL537567
Synonyms: (12aS)-6-(3,4-dimethoxyphenyl)-2-hexyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(c(c2)OC)OC)[nH]c2c1cccc2
STL537568
Synonyms: N-[3-(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoyl]-D-isoleucine
Smiles: CC[C@@H]([C@H](C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)OC)C
STL537569
Synonyms: (11R,13aS)-9-oxo-1,2,9,9a,10,11,13b,13c-octahydro-3aH-11,13a-epoxyfuro[3,2-c]isoindolo[2,1-a]quinoline-10-carboxylicacid
Smiles: OC(=O)C1[C@@H]2C=C[C@@]3(C1C(=O)N1C3C3CCOC3c3c1cccc3)O2
STL537570
Synonyms: (1S,5S)-N-{(2S)-1-[(4-butylphenyl)amino]-3-methyl-1-oxobutan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: CCCCc1ccc(cc1)NC(=O)[C@H](C(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL537571
Synonyms: 4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537572
Synonyms: N-(2-hydroxy-2-phenylethyl)-2-[(2-methyl-4-oxo-3-phenyl-4H-chromen-7-yl)oxy]acetamide
Smiles: O=C(NCC(c1ccccc1)O)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C
STL537573
Synonyms: 2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(3-methoxypropyl)benzamide
Smiles: COCCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL537574
Synonyms: (1S,5S)-N-{(2S)-1-[(4-methoxybenzyl)amino]-3-methyl-1-oxobutan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)[C@H](C(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL537575
Synonyms: tert-butyl{(2S)-4-methyl-1-[4-({(2S)-3-methyl-1-[(4-methylphenyl)amino]-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-1-oxopentan-2-yl}carbamate
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)C)C(C)C)NC(=O)OC(C)(C)C)C
STL537576
Synonyms: 6-(4-chlorophenyl)-2-pentyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCN1CC(=O)N2C(C1=O)Cc1c(C2c2ccc(cc2)Cl)[nH]c2c1cccc2
STL537577
Synonyms: tert-butyl{(2S)-4-methyl-1-[4-({(2S)-3-methyl-1-oxo-1-[(1-phenylethyl)amino]butan-2-yl}carbamoyl)piperidin-1-yl]-1-oxopentan-2-yl}carbamate
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NC(c1ccccc1)C)C(C)C)NC(=O)OC(C)(C)C)C
STL537578
Synonyms: (11aS)-2-benzyl-5-(4-methylphenyl)-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: Cc1ccc(cc1)C1N2C(=O)N(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1
STL537579
Synonyms: (12aS)-2-cyclohexyl-6-(3,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCC1
STL537580
Synonyms: (12aS)-2-{[(E)-(2,5-dimethoxyphenyl)methylidene]amino}-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1/C=N/N1CC(=O)N2[C@H](C1=O)Cc1c(C2(C)C)[nH]c2c1cccc2)OC
STL537581
Synonyms: (12aS)-2-butyl-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)OC)[nH]c2c1cccc2
STL537582
Synonyms: 7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-ylN-[(4-methylphenyl)sulfonyl]-L-leucinate
Smiles: CC(C[C@@H](C(=O)Oc1cc(C)cc2c1c1CCCc1c(=O)o2)NS(=O)(=O)c1ccc(cc1)C)C
STL537583
Synonyms: 2-(5,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[3-(1-hydroxyethyl)phenyl]acetamide
Smiles: COc1cc(OC)c2c(c1)oc(=O)c(c2C)CC(=O)Nc1cccc(c1)C(O)C
STL537584
Synonyms: (12aS)-2-[2-(4-chlorophenyl)ethyl]-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccc(cc1)Cl
STL537585
Synonyms: (3aS,6R,7R,7aS)-2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxyphenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1cc(cc(c1)OC)NC(=O)[C@H]1[C@@H]2C=C[C@@]3([C@H]1C(=O)N(C3)c1ccc3c(c1)OCO3)O2
STL537586
Synonyms: N-[(2,5-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetyl]-5-hydroxytryptophan
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C)NC(C(=O)O)Cc1c[nH]c2c1cc(O)cc2
STL537587
Synonyms: N~2~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-propan-2-yl-L-alaninamide
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)NC(C)C)C
STL537588
Synonyms: (5S)-3-{[(4-oxo-3-phenyl-4H-chromen-7-yl)oxy]acetyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)COc1ccc2c(c1)occ(c2=O)c1ccccc1
STL537589
Synonyms: (12aS)-2-(furan-2-ylmethyl)-6-(4-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Cc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccco1
STL537590
Synonyms: (12aS)-6-(3-methoxyphenyl)-2-propyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)OC)[nH]c2c1cccc2
STL537591
Synonyms: (12aS)-2-[2-(2-fluorophenyl)ethyl]-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccccc1F
STL537592
Synonyms: (12aS)-6-(3-chlorophenyl)-2-(2-methoxybenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)Cl)[nH]c2c1cccc2
STL537593
Synonyms: (12aS)-2-{[(E)-(2-ethoxyphenyl)methylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1/C=N/N1CC(=O)N2[C@H](C1=O)Cc1c(C2)[nH]c2c1cccc2
STL537594
Synonyms: N-[1-(1H-indol-3-yl)propan-2-yl]-2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]acetamide
Smiles: O=C(NC(Cc1c[nH]c2c1cccc2)C)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1
STL537595
Synonyms: (12aS)-6-(4-bromophenyl)-2-propyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)Br)[nH]c2c1cccc2
STL537596
Synonyms: (5-methoxy-1H-indol-3-yl)[(1S,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]aceticacid
Smiles: COc1ccc2c(c1)c(c[nH]2)C(N1C[C@@H]2C[C@H](C1)c1n(C2)c(=O)ccc1)C(=O)O
STL537597
Synonyms: (12aS)-6-(3,4-dimethoxyphenyl)-2-(tetrahydrofuran-2-ylmethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CC1CCCO1
STL537598
Synonyms: (12aS)-6-(4-ethoxy-3-methoxyphenyl)-2-[2-(4-methoxyphenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccc(cc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccc(cc1)OC
STL537599
Synonyms: (12aS)-6-(2-ethoxyphenyl)-2-(4-methoxybenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(cc1)OC
STL537600
Synonyms: 2'-[(4-bromophenyl)carbonyl]-5''-chloro-5',6',7',7a'-tetrahydrodispiro[indole-3,1'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Brc1ccc(cc1)C(=O)C1C2(C(=O)Nc3c2cc(Cl)cc3)N2C(C31C(=O)Nc1c3cccc1)CCC2
STL537601
Synonyms: N-(3-chlorophenyl)-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: Clc1cccc(c1)NC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537602
Synonyms: (12aS)-2-[2-(cyclohex-1-en-1-yl)ethyl]-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCC1=CCCCC1
STL537603
Synonyms: N-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]propanamide
Smiles: O=C(C(Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C)NCC(=O)N1CCC2(C(C1)CCCC2)O
STL537604
Synonyms: (1S,5R)-3-[(2,3,4,9-tetramethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1c(=O)oc2c(c1C)c1oc(c(c1c(c2)C)C)C
STL537605
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-valyl]piperidin-4-yl}carbonyl)-D-phenylalanine
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@@H](C(=O)O)Cc1ccccc1)C(C)C
STL537606
Synonyms: (12aS)-2-[2-(4-chlorophenyl)ethyl]-6-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(cc1)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2CCc2ccccc2)[nH]c2c1cccc2
STL537607
Synonyms: (3aR,6S,7aS)-2-[4-(acetylamino)phenyl]-1-oxo-N-(pyridin-3-ylmethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: CC(=O)Nc1ccc(cc1)N1C[C@]23[C@@H](C1=O)C([C@H](O3)C=C2)C(=O)NCc1cccnc1
STL537608
Synonyms: 2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-[3-(trifluoromethyl)benzyl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCc1cccc(c1)C(F)(F)F
STL537609
Synonyms: (8xi,14xi,17alpha)-3-[(2,6-dideoxy-3,4-O-ethylidenehexopyranosyl)oxy]-5,14-dihydroxy-19-oxocard-20(22)-enolide
Smiles: O=C[C@@]12CCC(CC2(O)CCC2[C@@H]1CC[C@]1(C2(O)CC[C@H]1C1=CC(=O)OC1)C)OC1OC(C)C2C(C1)OC(O2)C
STL537610
Synonyms: N-[(2S)-1-hydroxy-4-methylpentan-2-yl]-2-(4,8,8-trimethyl-2-oxo-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl)acetamide
Smiles: OC[C@@H](NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(C)C)CC(C)C
STL537611
Synonyms: (12aS)-6-(4-ethoxy-3-methoxyphenyl)-2-(4-fluorobenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccc(cc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(cc1)F
STL537612
Synonyms: (12aS)-2-{[(E)-(4-methoxyphenyl)methylidene]amino}-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)/C=N/N1CC(=O)N2[C@H](C1=O)Cc1c(C2(C)C)[nH]c2c1cccc2
STL537613
Synonyms: N-(4-hydroxy-1,1-dioxidotetrahydrothiophen-3-yl)-2-[(2-oxo-4-phenyl-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(NC1CS(=O)(=O)CC1O)COc1ccc2c(c1)oc(=O)cc2c1ccccc1
STL537614
Synonyms: (12aS)-2-(1,3-benzodioxol-5-ylmethyl)-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc2c(c1)OCO2
STL537615
Synonyms: (12aS)-6-(3,4-dimethoxyphenyl)-2-(2-methoxyethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(c(c2)OC)OC)[nH]c2c1cccc2
STL537616
Synonyms: N-(butan-2-yl)-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCC(NC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC)C
STL537617
Synonyms: (11aS)-2-(4-methoxyphenyl)-5-(4-methylphenyl)-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C)[nH]c2c1cccc2
STL537618
Synonyms: (12aS)-2-(3,4-dimethoxybenzyl)-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(ccc1OC)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OC)[nH]c2c1cccc2
STL537619
Synonyms: N-(2-hydroxy-2-phenylethyl)-3-(4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: O=C(CCn1cnc2c(c1=O)cccc2)NCC(c1ccccc1)O
STL537620
Synonyms: (12aS)-2-{[(E)-(3-bromophenyl)methylidene]amino}-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Brc1cccc(c1)/C=N/N1CC(=O)N2[C@H](C1=O)Cc1c(C2(C)C)[nH]c2c1cccc2
STL537621
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-3-methyl-1-oxo-1-[(1-phenylethyl)amino]butan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NC(c1ccccc1)C)C(C)C)NC(=O)OC(C)(C)C
STL537622
Synonyms: N-(2-methoxybenzyl)-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCc1ccccc1OC
STL537623
Synonyms: methyl(3S)-2-[(4-methylpiperidin-1-yl)acetyl]-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate
Smiles: COC(=O)[C@@H]1Cc2c(CN1C(=O)CN1CCC(CC1)C)[nH]c1c2cccc1
STL537624
Synonyms: (12aS)-2-butyl-6-(3,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(c(c2)OC)OC)[nH]c2c1cccc2
STL537625
Synonyms: N-[3-(diethylamino)propyl]-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCN(CCCNC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)CC
STL537626
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(1,3-benzodioxol-5-yl)-1-ethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCN1c2ccccc2[C@@]2(C1=O)N1CCC[C@H]1[C@@H]1[C@H]2C(=O)N(C1=O)c1ccc2c(c1)OCO2
STL537627
Synonyms: N-(4-oxo-4-{[(5alpha,8xi,9xi,14xi)-3-oxoandrostan-17-yl]oxy}butanoyl)tryptophan
Smiles: O=C(NC(C(=O)O)Cc1c[nH]c2c1cccc2)CCC(=O)OC1CCC2[C@]1(C)CCC1C2CC[C@@H]2[C@]1(C)CCC(=O)C2
STL537628
Synonyms: methyl6-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]hexanoate
Smiles: COC(=O)CCCCCN1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537629
Synonyms: 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl2-[(tert-butoxycarbonyl)amino]butanoate
Smiles: CCC(C(=O)Oc1ccc2c(c1C)oc(=O)cc2CC)NC(=O)OC(C)(C)C
STL537630
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-phenylalanyl]piperidin-4-yl}carbonyl)-L-phenylalanine
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc1ccccc1
STL537631
Synonyms: N-[(6S,6aR,13S,13aS)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-ylcarbonothioyl]-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)NC(=S)N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31
STL537632
Synonyms: (12aS)-2-(1,3-benzodioxol-5-ylmethyl)-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc2c(c1)OCO2
STL537633
Synonyms: (8xi,9xi,14xi)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl4-oxo-4-[(tetrahydrofuran-2-ylmethyl)amino]butanoate
Smiles: O=C(CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1C2CCC2=CC(=O)CC[C@]12C)NCC1CCCO1
STL537634
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-octylbenzamide
Smiles: CCCCCCCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537635
Synonyms: (11bS)-8-methoxy-11b-methyl-2-[4-(propan-2-yl)phenyl]-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccc(cc1)C(C)C
STL537636
Synonyms: (1'R,2'R)-2'-(4-methoxyphenyl)-8'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cc(C)cc1
STL537637
Synonyms: N-[(2-methyl-1,3-thiazol-4-yl)acetyl]tryptophan
Smiles: O=C(NC(C(=O)O)Cc1c[nH]c2c1cccc2)Cc1csc(n1)C
STL537638
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-1-[(2-methoxy-5-methylphenyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-4-methyl-1-oxopentan-2-yl}carbamate
Smiles: COc1ccc(cc1NC(=O)[C@@H](NC(=O)C1CCN(CC1)C(=O)[C@@H](NC(=O)OC(C)(C)C)CC(C)C)C)C
STL537639
Synonyms: phenyl{[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}aceticacid
Smiles: O=C(NC(c1ccccc1)C(=O)O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C
STL537640
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-alanyl]piperidin-4-yl}carbonyl)-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@@H](NC(=O)OC(C)(C)C)C
STL537641
Synonyms: N-(6-methylheptan-2-yl)-2-[2-(1H-pyrrol-1-yl)-1,3-thiazol-5-yl]acetamide
Smiles: CC(NC(=O)Cc1cnc(s1)n1cccc1)CCCC(C)C
STL537642
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-1-[(4-fluorophenyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-4-methyl-1-oxopentan-2-yl}carbamate
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)F)C)NC(=O)OC(C)(C)C)C
STL537643
Synonyms: (12aS)-2-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1N(Cc2ccc3c(c2)OCO3)CC(=O)N2[C@H]1Cc1c(C2C)[nH]c2c1cccc2
STL537644
Synonyms: N-cycloheptyl-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NC1CCCCCC1
STL537645
Synonyms: N-(4-fluorophenyl)-4-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccc(cc1)C(=O)Nc1ccc(cc1)F
STL537646
Synonyms: (1'R,2'R)-1'-acetyl-2'-(3-methoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL537647
Synonyms: methyl2-[(11aS)-1,3-dioxo-5-[4-(propan-2-yl)phenyl]-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1ccc(cc1)C(C)C)c1c(C2)c2ccccc2[nH]1
STL537648
Synonyms: 6-(4-chlorophenyl)-2-[3-(morpholin-4-yl)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(cc1)C1N2C(=O)CN(C(=O)C2Cc2c1[nH]c1c2cccc1)CCCN1CCOCC1
STL537649
Synonyms: methyl2-[({1-[ethoxy(oxo)acetyl]-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl}carbonyl)amino]benzoate
Smiles: CCOC(=O)C(=O)C1N(CCc2c1[nH]c1c2cccc1)C(=O)Nc1ccccc1C(=O)OC
STL537650
Synonyms: N~5~-carbamoyl-N~2~-[(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-D-ornithine
Smiles: Cc1c(CC(=O)N[C@@H](C(=O)O)CCCNC(=O)N)c(=O)oc2c1cc1c(C)c(oc1c2)C
STL537651
Synonyms: N-[({[(3E,8xi,9xi,14xi)-17-hydroxypregn-4-en-20-yn-3-ylidene]amino}oxy)acetyl]valyl-4-hydroxyproline
Smiles: C#C[C@@]1(O)CCC2[C@]1(C)CCC1C2CCC2=C/C(=N/OCC(=O)NC(C(=O)N3CC(CC3C(=O)O)O)C(C)C)/CC[C@]12C
STL537653
Synonyms: (3aR,6S,7aS)-N-(3-fluorophenyl)-2-[2-(1H-indol-3-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: Fc1cccc(c1)NC(=O)C1[C@H]2C=C[C@]3([C@H]1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2
STL537654
Synonyms: (12aS)-6-(2,3-dimethoxyphenyl)-2-heptyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2OC)OC)[nH]c2c1cccc2
STL537655
Synonyms: (5alpha,8xi,9xi,14xi)-3-oxoandrostan-17-yl4-[(2,5-dioxopyrrolidin-1-yl)oxy]-4-oxobutanoate
Smiles: O=C(OC1CCC2[C@]1(C)CCC1C2CC[C@@H]2[C@]1(C)CCC(=O)C2)CCC(=O)ON1C(=O)CCC1=O
STL537656
Synonyms: N-(4-butoxyphenyl)-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCOc1ccc(cc1)NC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537657
Synonyms: 2-oxo-4-propyl-2H-chromen-7-ylN-(tert-butoxycarbonyl)-D-tryptophanate
Smiles: CCCc1cc(=O)oc2c1ccc(c2)OC(=O)[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)OC(C)(C)C
STL537658
Synonyms: N-[3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]-D-methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)OC
STL537659
Synonyms: (1S,5S)-N-{(2S)-1-[(4-fluorophenyl)amino]-1-oxo-3-phenylpropan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1ccccc1
STL537660
Synonyms: 6-(4-chlorophenyl)-2-(4-methoxybenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CN1CC(=O)N2C(C1=O)Cc1c(C2c2ccc(cc2)Cl)[nH]c2c1cccc2
STL537661
Synonyms: (11aS)-2-[4-(pentafluorophenoxy)phenyl]-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: O=C1N2Cc3[nH]c4c(c3C[C@H]2C(=O)N1c1ccc(cc1)Oc1c(F)c(F)c(c(c1F)F)F)cccc4
STL537662
Synonyms: 3-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4,8-dimethyl-7-(naphthalen-2-ylmethoxy)-2H-chromen-2-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)Cc1c(=O)oc2c(c1C)ccc(c2C)OCc1ccc2c(c1)cccc2
STL537663
Synonyms: 1-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-N-[2-(4-methoxyphenyl)ethyl]-5-oxo-L-prolinamide
Smiles: COc1ccc(cc1)CCNC(=O)[C@@H]1CCC(=O)N1C1OC(=O)c2c1ccc(c2OC)OC
STL537664
Synonyms: (12aS)-6-(4-chlorophenyl)-2-[2-(4-chlorophenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(cc1)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)Cl)[nH]c2c1cccc2
STL537665
Synonyms: 3-(4-bromophenyl)-6-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-5-methyl-7H-furo[3,2-g]chromen-7-one
Smiles: Brc1ccc(cc1)c1coc2c1cc1c(c2)oc(=O)c(c1C)CCC(=O)N1CCC2(C(C1)CCCC2)O
STL537666
Synonyms: (12aS)-2-[2-(4-fluorophenyl)ethyl]-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Fc1ccc(cc1)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2C)[nH]c2c1cccc2
STL537667
Synonyms: (12aS)-2-(3-hydroxypropyl)-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: OCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)OC)[nH]c2c1cccc2
STL537668
Synonyms: (12aS)-2-(4-methoxybenzyl)-6-(3-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)C)[nH]c2c1cccc2
STL537669
Synonyms: (12aS)-2-(butan-2-yl)-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCC(N1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C(C)C)[nH]c2c1cccc2)C
STL537670
Synonyms: (12aS)-2-butyl-6-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2C)[nH]c2c1cccc2
STL537671
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-valyl]piperidin-4-yl}carbonyl)-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@H](C(C)C)NC(=O)OC(C)(C)C)C
STL537672
Synonyms: N-[(7S)-10-(cycloheptylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Smiles: COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NC2CCCCCC2)NC(=O)C)cc(c1OC)OC
STL537673
Synonyms: (12aS)-6-(4-methylphenyl)-2-pentyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C)[nH]c2c1cccc2
STL537674
Synonyms: 7-({1-[1-(4-chlorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-1-oxopropan-2-yl}oxy)-8-methyl-4-propyl-2H-chromen-2-one
Smiles: CCCc1cc(=O)oc2c1ccc(c2C)OC(C(=O)N1CCC2(C(C1c1ccc(cc1)Cl)CCCC2)O)C
STL537675
Synonyms: N-[2-(4-methoxyphenyl)ethyl]-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc(cc1)CCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537676
Synonyms: (12aS)-2-(3-ethoxypropyl)-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2C)[nH]c2c1cccc2
STL537677
Synonyms: 4-[(3S,3a'R,8a'S,8b'S)-5-bromo-1',2,3'-trioxo-1,1',2,3',3a',6',7',8',8a',8b'-decahydro-2'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizin]-2'-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Br)cc2
STL537678
Synonyms: N-(4-methylbenzyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: Cc1ccc(cc1)CNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537679
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-[3-(propan-2-yloxy)propyl]benzamide
Smiles: CC(OCCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C
STL537681
Synonyms: (12aS)-2-(1-benzylpiperidin-4-yl)-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCN(CC1)Cc1ccccc1
STL537682
Synonyms: (1'R,2'R)-2'-(2,4-dimethoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1)OC)[C@H]1[C@H](C(=O)c2cccc(c2)OC)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL537683
Synonyms: N-(3,4-dimethoxybenzyl)-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1cc(CNC(=O)c2ccc(cc2)N2C(=O)N3[C@@](C2=O)(C)c2[nH]c4c(c2CC3)cccc4)ccc1OC
STL537684
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-benzyl-1-ethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCN1c2ccccc2[C@@]2(C1=O)N1CCC[C@H]1[C@@H]1[C@H]2C(=O)N(C1=O)Cc1ccccc1
STL537685
Synonyms: (12aS)-6-(2-ethoxyphenyl)-2-(3-methylbutyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCC(C)C
STL537686
Synonyms: N-[3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]glycyl-L-valine
Smiles: O=C(CCc1c(=O)oc2c(c1C)ccc(c2)O)NCC(=O)N[C@H](C(=O)O)C(C)C
STL537687
Synonyms: (11bS)-11b-methyl-2-[4-(methylsulfanyl)phenyl]-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: CSc1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537688
Synonyms: 1-{[({[(3Z,8xi,9xi,14xi)-17-hydroxy-20-oxopregn-4-en-3-ylidene]amino}oxy)acetyl]oxy}pyrrolidine-2,5-dione
Smiles: O=C(ON1C(=O)CCC1=O)CO/N=C\1/CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CC[C@]2(O)C(=O)C)C)C
STL537689
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-1-[(4-methylbenzyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl}carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)C)C)Cc1ccccc1
STL537690
Synonyms: (12bS)-9-methoxy-12b-methyl-2-(1-phenylethyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)C(c1ccccc1)C
STL537691
Synonyms: (12aS)-6-(4-ethoxy-3-methoxyphenyl)-2-(2-methylpropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccc(cc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CC(C)C
STL537692
Synonyms: (12aS)-2-pentyl-6-(3,4,5-trimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cc(OC)c(c(c2)OC)OC)[nH]c2c1cccc2
STL537693
Synonyms: methyl2-[(11aS)-5-(3-methylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1cccc(c1)C)c1c(C2)c2ccccc2[nH]1
STL537694
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(1,3-benzodioxol-5-yl)-6,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2ccc3c(c2)OCO3)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1ccc(c2C)C
STL537695
Synonyms: N-[(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]-D-valine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2)N[C@@H](C(=O)O)C(C)C
STL537696
Synonyms: 2-({[(3E,9xi,14xi)-17-hydroxypregn-4-en-20-yn-3-ylidene]amino}oxy)-N-(2-phenylethyl)acetamide
Smiles: C#C[C@@]1(O)CCC2[C@]1(C)CCC1[C@H]2CCC2=C/C(=N/OCC(=O)NCCc3ccccc3)/CC[C@]12C
STL537697
Synonyms: trans-4-{[({1-[N-(tert-butoxycarbonyl)-L-leucyl]piperidin-4-yl}carbonyl)amino]methyl}cyclohexanecarboxylicacid
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)O)NC(=O)OC(C)(C)C)C
STL537698
Synonyms: 4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(tetrahydrofuran-2-ylmethyl)benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCC1CCCO1
STL537699
Synonyms: methylN-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-L-alaninate
Smiles: COC(=O)[C@@H](NC(=O)Cn1cnc2c(c1=O)cc(c(c2)OC)OC)C
STL537700
Synonyms: (12aS)-2-(1,3-benzodioxol-5-ylmethyl)-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1N(Cc2ccc3c(c2)OCO3)CC(=O)N2[C@H]1Cc1c(C2c2ccccc2C)[nH]c2c1cccc2
STL537701
Synonyms: N-(2,4-dimethoxybenzyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc(c(c1)OC)CNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537702
Synonyms: (12aS)-6-(4-methylphenyl)-2-[3-(morpholin-4-yl)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Cc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCN1CCOCC1
STL537703
Synonyms: (12aS)-2-(1,3-benzodioxol-5-ylmethyl)-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(Cc2ccc3c(c2)OCO3)C(=O)[C@H]2N1C(c1ccc(cc1)C(C)C)c1c(C2)c2c([nH]1)cccc2
STL537704
Synonyms: (12aS)-2-benzyl-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1
STL537705
Synonyms: (12bR)-2-{[(E)-(2,4-dichlorophenyl)methylidene]amino}-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(c(c1)Cl)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537706
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(1-phenylethyl)benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NC(c1ccccc1)C
STL537707
Synonyms: 3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4-methyl-7-(naphthalen-2-ylmethoxy)-2H-chromen-2-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc2c(c1)cccc2
STL537708
Synonyms: 1-methyl-3-(1-methyl-1H-indol-3-yl)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1C)c1cn(c2c1cccc2)C
STL537709
Synonyms: (3S,11E)-16-hydroxy-3-methyl-14-[(2-methylbenzyl)oxy]-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione
Smiles: O=C1CCC/C=C/c2cc(OCc3ccccc3C)cc(c2C(=O)O[C@H](CCC1)C)O
STL537710
Synonyms: 2-(5,7-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(2-hydroxy-3-methoxypropyl)acetamide
Smiles: COCC(CNC(=O)Cc1c(=O)oc2c(c1C)c(O)cc(c2)O)O
STL537711
Synonyms: (12aS)-2-hexyl-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2C)[nH]c2c1cccc2
STL537712
Synonyms: (5S)-3-[(2-phenyl-1H-indol-1-yl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cn1c(cc2c1cccc2)c1ccccc1
STL537713
Synonyms: (3S,11E)-16-hydroxy-3-methyl-14-{[3-(trifluoromethyl)benzyl]oxy}-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione
Smiles: O=C1CCC/C=C/c2cc(OCc3cccc(c3)C(F)(F)F)cc(c2C(=O)O[C@H](CCC1)C)O
STL537714
Synonyms: N,N-dibutyl-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCN(C(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)CCCC
STL537715
Synonyms: 2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(4-methylbenzyl)benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCc1ccc(cc1)C
STL537716
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,5-dimethoxyphenyl)-6,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1ccc(c2C)C)OC
STL537717
Synonyms: (12aS)-6-(4-bromophenyl)-2-cyclohexyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Brc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCC1
STL537718
Synonyms: 2-({[(3E,8xi,9xi,14xi,17beta)-17-hydroxy-17-methylandrosta-1,4-dien-3-ylidene]amino}oxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide
Smiles: O=C(CO/N=C/1\C=C[C@]2(C(=C1)CCC1C2CC[C@]2(C1CC[C@]2(C)O)C)C)NCCc1c[nH]c2c1cccc2
STL537719
Synonyms: (12aS)-2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(3-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1OC)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)C)[nH]c2c1cccc2
STL537720
Synonyms: 6-(4-chlorophenyl)-2-[2-(4-methoxyphenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CCN1CC(=O)N2C(C1=O)Cc1c(C2c2ccc(cc2)Cl)[nH]c2c1cccc2
STL537721
Synonyms: 3-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-7-[(3-methoxybenzyl)oxy]-4,8-dimethyl-2H-chromen-2-one
Smiles: COc1cccc(c1)COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)N1CCC2(C(C1)CCCC2)O
STL537722
Synonyms: methyl4-[(12aS)-2-(3,4-dimethoxybenzyl)-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-6-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(c(c1)OC)OC
STL537723
Synonyms: N-[(4,8,8-trimethyl-2-oxo-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl)acetyl]-L-phenylalanine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(C)C)N[C@H](C(=O)O)Cc1ccccc1
STL537724
Synonyms: 3-[(6-acetyl-1,3-benzodioxol-5-yl)carbamoyl]-2,2-dimethylcyclopropanecarboxylicacid
Smiles: O=C(C1C(C1(C)C)C(=O)O)Nc1cc2OCOc2cc1C(=O)C
STL537725
Synonyms: 6-(4-chlorophenyl)-2-propyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCN1CC(=O)N2C(C1=O)Cc1c(C2c2ccc(cc2)Cl)[nH]c2c1cccc2
STL537726
Synonyms: (1S,5S)-N-{(2S)-1-[(4-butoxyphenyl)amino]-3-methyl-1-oxobutan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: CCCCOc1ccc(cc1)NC(=O)[C@H](C(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL537727
Synonyms: 5-(4-methoxybenzyl)-2,2-dimethyl-5-{[(5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-1,3-dioxane-4,6-dione
Smiles: COc1ccc(cc1)CC1(CN2C[C@@H]3C[C@H](C2)c2n(C3)c(=O)ccc2)C(=O)OC(OC1=O)(C)C
STL537728
Synonyms: 4-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(3-methoxyphenyl)benzamide
Smiles: COc1cccc(c1)NC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL537729
Synonyms: (12aS)-2-hexyl-6-(4-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C)[nH]c2c1cccc2
STL537730
Synonyms: (12aS)-6-(2,5-dimethoxyphenyl)-2-(4-methylcyclohexyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCC(CC1)C)OC
STL537731
Synonyms: (12aS)-2-(4-fluorobenzyl)-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Fc1ccc(cc1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2C)[nH]c2c1cccc2
STL537732
Synonyms: (12bS)-9-methoxy-12b-methyl-2-(3-phenylpropyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)CCCc1ccccc1
STL537734
Synonyms: (12aS)-2-butyl-6-(2,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2OC)OC)[nH]c2c1cccc2
STL537735
Synonyms: (12aS)-2-cyclohexyl-6-(2,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(OC)ccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCC1
STL537736
Synonyms: (12aS)-6-(2-ethoxyphenyl)-2-(2-hydroxyethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: OCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OCC)[nH]c2c1cccc2
STL537737
Synonyms: (3S,11E)-14,16-dimethoxy-3-methyl-7-[(2-phenylethyl)amino]-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-1-one
Smiles: COc1cc2/C=C/CCCC(CCC[C@@H](OC(=O)c2c(c1)OC)C)NCCc1ccccc1
STL537738
Synonyms: (12aS)-2-(3,4-dimethoxybenzyl)-6-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1OC)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2CCc2ccccc2)[nH]c2c1cccc2
STL537739
Synonyms: N-cycloheptyl-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NC1CCCCCC1
STL537740
Synonyms: N~2~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-(6-methylheptan-2-yl)-L-valinamide
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)NC(CCCC(C)C)C)C(C)C
STL537741
Synonyms: N-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]propanamide
Smiles: CCCc1cc(=O)oc2c1ccc(c2C)OC(C(=O)NCC(=O)N1CCC2(C(C1)CCCC2)O)C
STL537742
Synonyms: N-[(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-D-valine
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)N[C@@H](C(=O)O)C(C)C
STL537743
Synonyms: 2-{[(E)-(3-fluorophenyl)methylidene]amino}-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Fc1cccc(c1)/C=N/N1CC(=O)N2C(C1=O)Cc1c(C2(C)C)[nH]c2c1cccc2
STL537744
Synonyms: N-(4-oxo-4-{[(8xi,9xi,14xi)-3-oxoandrost-4-en-17-yl]oxy}butanoyl)glutamicacid
Smiles: O=C(NC(C(=O)O)CCC(=O)O)CCC(=O)OC1CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C
STL537745
Synonyms: (5alpha,8xi,9xi,14xi)-17-oxoandrostan-3-yl3-(piperidin-1-yl)propanoate
Smiles: O=C(OC1CC[C@]2([C@H](C1)CCC1C2CC[C@]2(C1CCC2=O)C)C)CCN1CCCCC1
STL537746
Synonyms: (12aS)-2-(3-methoxypropyl)-6-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2C)[nH]c2c1cccc2
STL537747
Synonyms: N-[(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]-D-methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
STL537748
Synonyms: (11bS)-2-[2-chloro-5-(trifluoromethyl)phenyl]-8-methoxy-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1cc(ccc1Cl)C(F)(F)F
STL537749
Synonyms: 4-chloro-N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]phenylalanine
Smiles: O=C(NC(C(=O)O)Cc1ccc(cc1)Cl)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C
STL537751
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-3-methyl-1-oxo-1-[(1-phenylethyl)amino]butan-2-yl}carbamoyl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl}carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NC(c1ccccc1)C)C(C)C)Cc1ccccc1
STL537752
Synonyms: (12aS)-2-[3-(dibutylamino)propyl]-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCN(CCCC)CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C(C)C)[nH]c2c1cccc2
STL537754
Synonyms: (12aS)-6-(3-methoxyphenyl)-2-(3-phenylpropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCc1ccccc1
STL537755
Synonyms: N-[({[(3E,8xi,9xi,14xi)-17-hydroxypregn-4-en-20-yn-3-ylidene]amino}oxy)acetyl]valylglycine
Smiles: CC(C(C(=O)NCC(=O)O)NC(=O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CC[C@]2(O)C#C)C)C)C
STL537756
Synonyms: (1S,5S)-8-oxo-N-{(2S)-1-oxo-1-[(4-phenoxyphenyl)amino]-3-phenylpropan-2-yl}-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: O=C([C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1ccccc1)Nc1ccc(cc1)Oc1ccccc1
STL537757
Synonyms: 2-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-[(1-ethylpyrrolidin-2-yl)methyl]acetamide
Smiles: CCN1CCCC1CNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C
STL537758
Synonyms: N-(furan-2-ylmethyl)-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCc1ccco1
STL537759
Synonyms: 6-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-5-methyl-3-phenyl-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1
STL537760
Synonyms: (12aS)-6-(2-ethoxyphenyl)-2-[2-(3-fluorophenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1cccc(c1)F
STL537761
Synonyms: 4,7-dimethyl-2-oxo-2H-chromen-5-ylN-(tert-butoxycarbonyl)-L-alaninate
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)Oc1cc(C)cc2c1c(C)cc(=O)o2)C
STL537762
Synonyms: (11bS)-2-[2-chloro-5-(trifluoromethyl)phenyl]-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: Clc1ccc(cc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C(F)(F)F
STL537763
Synonyms: (12bS)-7-(2-chlorophenyl)-12b-methyl-2-(2-methylpropyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: CC(CN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1ccccc1Cl)cccc3)C
STL537764
Synonyms: 7-[(2-bromobenzyl)oxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4,8-dimethyl-2H-chromen-2-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)ccc(c2C)OCc1ccccc1Br
STL537765
Synonyms: (12aS)-6-(3-methoxyphenyl)-2-(4-methylbenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(cc1)C
STL537766
Synonyms: N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)-3-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}propanamide
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NC1C=CS(=O)(=O)C1
STL537767
Synonyms: (3aS,6R,7aR)-N-(3,4-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1ccc(cc1)N1C[C@@]23[C@H](C1=O)C([C@@H](O3)C=C2)C(=O)Nc1ccc(c(c1)OC)OC
STL537768
Synonyms: (12bS)-2-(2,4-dichlorobenzyl)-9-fluoro-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(c(c1)Cl)CN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)F
STL537769
Synonyms: (12aS)-2-[3-(dimethylamino)propyl]-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CN(CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C(C)C)[nH]c2c1cccc2)C
STL537770
Synonyms: (12aS)-2-{[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1cc(/C=N/N2CC(=O)N3[C@H](C2=O)Cc2c(C3)[nH]c3c2cccc3)ccc1O
STL537771
Synonyms: (12bR)-12b-methyl-2-{[(E)-(3-phenoxyphenyl)methylidene]amino}-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(/N=C/c2cccc(c2)Oc2ccccc2)C(=O)[C@@]2(N1CCc1c2[nH]c2c1cccc2)C
STL537772
Synonyms: (12aS)-2-(1-benzylpiperidin-4-yl)-6-(2,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(OC)ccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCN(CC1)Cc1ccccc1
STL537773
Synonyms: 6-{2-[1-(4-chlorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-2-oxoethyl}-2,3,5-trimethyl-7H-furo[3,2-g]chromen-7-one
Smiles: Clc1ccc(cc1)C1N(CCC2(C1CCCC2)O)C(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
STL537774
Synonyms: N-(4-oxo-4-{[(5alpha,8xi,9xi,14xi)-3-oxoandrostan-17-yl]oxy}butanoyl)phenylalanine
Smiles: O=C(NC(C(=O)O)Cc1ccccc1)CCC(=O)OC1CCC2[C@]1(C)CCC1C2CC[C@@H]2[C@]1(C)CCC(=O)C2
STL537775
Synonyms: N-[4-(benzyloxy)phenyl]-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)Nc1ccc(cc1)OCc1ccccc1
STL537776
Synonyms: (3S,3a'R,8a'S,8b'S)-6,7-dimethyl-2'-(4-methylphenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1ccc(c2C)C
STL537777
Synonyms: 4-({[({[(3E,8xi,9xi,14xi,17xi)-20-oxopregn-4-en-3-ylidene]amino}oxy)acetyl]amino}methyl)benzoicacid
Smiles: O=C(NCc1ccc(cc1)C(=O)O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2C(=O)C)C)C
STL537778
Synonyms: (11bS)-11b-methyl-2-[(4-methylphenyl)sulfonyl]-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: Cc1ccc(cc1)S(=O)(=O)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537779
Synonyms: methyl4-methyl-2-{[4-methyl-3-(3-methylbutyl)-2-oxo-2H-chromen-7-yl]oxy}pentanoate
Smiles: COC(=O)C(Oc1ccc2c(c1)oc(=O)c(c2C)CCC(C)C)CC(C)C
STL537780
Synonyms: 3-benzyl-4-methyl-2-oxo-2H-chromen-7-ylN-(tert-butoxycarbonyl)norvalinate
Smiles: CCCC(C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1)NC(=O)OC(C)(C)C
STL537781
Synonyms: S-benzyl-N-[(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]-D-cysteine
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2C)O)N[C@@H](C(=O)O)CSCc1ccccc1
STL537782
Synonyms: (2E)-1-[1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-3-phenylprop-2-en-1-one
Smiles: CCOc1ccccc1C1N(CCC2(C1CCCC2)O)C(=O)/C=C/c1ccccc1
STL537783
Synonyms: (12aS)-6-(3-chlorophenyl)-2-[2-(4-fluorophenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Fc1ccc(cc1)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)Cl)[nH]c2c1cccc2
STL537785
Synonyms: (1'R,2'R)-1'-acetyl-2'-(3,4-dimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1OC)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL537786
Synonyms: 2-oxo-4-propyl-2H-chromen-7-ylN-[(4-methylphenyl)sulfonyl]norleucinate
Smiles: CCCCC(C(=O)Oc1ccc2c(c1)oc(=O)cc2CCC)NS(=O)(=O)c1ccc(cc1)C
STL537788
Synonyms: (12aS)-6-(2,5-dimethoxyphenyl)-2-(3-methoxybenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cc(OC)ccc2OC)[nH]c2c1cccc2
STL537789
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(pyridin-3-ylmethyl)benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1cccnc1
STL537790
Synonyms: N-(2-chlorobenzyl)-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCc1ccccc1Cl
STL537791
Synonyms: N-butyl-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL537792
Synonyms: (12bR)-2-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(/C=N/N2CC(=O)N3[C@](C2=O)(C)c2[nH]c4c(c2CC3)cccc4)ccc1OC
STL537793
Synonyms: butyl(3aS,6R,7aR)-2-(4-bromophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Smiles: CCCCOC(=O)C1[C@@H]2C=C[C@@]3([C@@H]1C(=O)N(C3)c1ccc(cc1)Br)O2
STL537794
Synonyms: N~2~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-(pyridin-2-ylmethyl)-L-valinamide
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)NCc1ccccn1)C(C)C
STL537795
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamide
Smiles: O=C(NC1CCOC(C1)(C)C)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C
STL537796
Synonyms: 2-(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)-N-[(2S)-1-hydroxypropan-2-yl]acetamide
Smiles: OC[C@@H](NC(=O)Cn1cnc2c(c1=O)cc(c(c2)OC)OC)C
STL537797
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-tryptophyl]piperidin-4-yl}carbonyl)-N-methylglycine
Smiles: OC(=O)CN(C(=O)C1CCN(CC1)C(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)OC(C)(C)C)C
STL537798
Synonyms: N-cyclohexyl-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NC1CCCCC1
STL537799
Synonyms: {[(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]amino}(phenyl)aceticacid
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)NC(c1ccccc1)C(=O)O
STL537800
Synonyms: (12aS)-6-(3,4-dimethoxyphenyl)-2-(4-fluorobenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(cc1)F
STL537801
Synonyms: 1-(2-methoxyphenyl)-2-(4-methylbenzyl)octahydroisoquinolin-4a(2H)-ol
Smiles: COc1ccccc1C1N(CCC2(C1CCCC2)O)Cc1ccc(cc1)C
STL537803
Synonyms: (1S,5R)-N-[(2S)-1-{[4-(benzyloxy)phenyl]amino}-3-methyl-1-oxobutan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: CC([C@@H](C(=O)Nc1ccc(cc1)OCc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C
STL537804
Synonyms: N-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-L-valine
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)O)C(C)C
STL537805
Synonyms: 2-{[3-methyl-2-({[(3aR,5S,5aR,8aS,8bR)-2,2,7,7-tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl]carbonyl}amino)butanoyl]amino}propanoicacid(non-preferredname)
Smiles: CC(C(C(=O)NC(C(=O)O)C)NC(=O)[C@H]1O[C@@H]2OC(O[C@@H]2[C@@H]2[C@H]1OC(O2)(C)C)(C)C)C
STL537806
Synonyms: (12aS)-2-{[(E)-(2,4-dichlorophenyl)methylidene]amino}-6-phenyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(c(c1)Cl)/C=N/N1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2)[nH]c2c1cccc2
STL537807
Synonyms: (11aS)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[4-(propan-2-yl)phenyl]-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: CC(c1ccc(cc1)C1N2C(=O)N(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)c1ccc2c(c1)OCCO2)C
STL537808
Synonyms: 3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-[3-(morpholin-4-yl)propyl]benzamide
Smiles: O=C(c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCCCN1CCOCC1
STL537809
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2-bromophenyl)-5,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1cc(C)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Br
STL537810
Synonyms: methyl4-[(12aS)-2-heptyl-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-6-yl]benzoate
Smiles: CCCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C(=O)OC)[nH]c2c1cccc2
STL537811
Synonyms: 3-butan-2-yl-1-(2-{6-[(E)-(hydroxyimino)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-1-methylthiourea
Smiles: O/N=C/c1c(CCN(C(=S)NC(CC)C)C)cc2c(c1OC)OCO2
STL537812
Synonyms: (12bS)-7-(2-chlorophenyl)-12b-methyl-2-(prop-2-en-1-yl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: C=CCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1ccccc1Cl)cccc3
STL537813
Synonyms: (12aS)-2-(2-hydroxyethyl)-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: OCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C(C)C)[nH]c2c1cccc2
STL537814
Synonyms: (12aS)-6-(2,5-dimethoxyphenyl)-2-(5-hydroxypentyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: OCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cc(OC)ccc2OC)[nH]c2c1cccc2
STL537815
Synonyms: (1S,5S)-N-{(2S)-3-methyl-1-oxo-1-[(4-phenoxyphenyl)amino]butan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: CC([C@@H](C(=O)Nc1ccc(cc1)Oc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C
STL537816
Synonyms: N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-D-alanine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C)N[C@@H](C(=O)O)C
STL537817
Synonyms: N-(4-methoxybenzyl)-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc(cc1)CNC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537818
Synonyms: (12aS)-2-cyclopentyl-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCC1
STL537819
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2ccc3c(c2)OCCO3)C(=O)[C@H]2[C@@H]1[C@]1(C(=O)Nc3c1ccc(c3C)C)N1[C@H]2CCC1
STL537820
Synonyms: methyl4-[(12aS)-2-(butan-2-yl)-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-6-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C(CC)C
STL537821
Synonyms: (1S,5S)-N-[(2S)-3-methyl-1-oxo-1-{[4-(propan-2-yl)phenyl]amino}butan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: CC(c1ccc(cc1)NC(=O)[C@H](C(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C
STL537822
Synonyms: N-(2-chlorobenzyl)-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1ccccc1Cl
STL537823
Synonyms: (3R,11E)-14-[(4-bromo-2-fluorobenzyl)oxy]-16-hydroxy-3-methyl-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione
Smiles: O=C1CCC/C=C/c2cc(OCc3ccc(cc3F)Br)cc(c2C(=O)O[C@@H](CCC1)C)O
STL537824
Synonyms: (12aS)-6-(3-bromophenyl)-2-(propan-2-yl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Brc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C(C)C
STL537825
Synonyms: N-[(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]norvaline
Smiles: CCCC(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
STL537826
Synonyms: (12aS)-6-(2-methoxyphenyl)-2-pentyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OC)[nH]c2c1cccc2
STL537827
Synonyms: (12aS)-2-benzyl-6-(2,3-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1
STL537828
Synonyms: 6-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-3-(4-methoxyphenyl)-5,9-dimethyl-7H-furo[3,2-g]chromen-7-one
Smiles: COc1ccc(cc1)c1coc2c1cc1c(C)c(CCC(=O)N3CCC4(C(C3)CCCC4)O)c(=O)oc1c2C
STL537829
Synonyms: (11aS)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dimethyl-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: O=C1N(c2ccc3c(c2)OCCO3)C(=O)N2[C@H]1Cc1c3ccccc3[nH]c1C2(C)C
STL537830
Synonyms: methyl4-hydroxy-1-[({[(3Z,8xi,9xi,14xi)-17-hydroxypregn-4-en-20-yn-3-ylidene]amino}oxy)acetyl]prolinate
Smiles: COC(=O)C1CC(CN1C(=O)CO/N=C\1/CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CC[C@]2(O)C#C)C)C)O
STL537831
Synonyms: 1-C-[6-oxo-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl]pentitol
Smiles: OCC(C(C(C(C1N2CC3(CN1CC(C2)(C3=O)C(C)C)C(C)C)O)O)O)O
STL537832
Synonyms: (12aS)-2-[2-(cyclohex-1-en-1-yl)ethyl]-6-(3,4,5-trimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCC1=CCCCC1
STL537833
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-benzyl-5-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)Cc1ccccc1
STL537834
Synonyms: 17-hydroxy-3,20-dioxopregn-4-en-21-yl4-oxo-4-[(2-phenylethyl)amino]butanoate
Smiles: O=C(OCC(=O)[C@@]1(O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C)CCC(=O)NCCc1ccccc1
STL537835
Synonyms: (5s,7s)-2-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Smiles: CC1(C)OCCC(C1)C1N2C[C@]3(CN1C[C@@](C2)(C3)C)C
STL537836
Synonyms: N-{(2S)-1-[(3,4-dimethoxyphenyl)amino]-1-oxopropan-2-yl}-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)[C@@H](NC(=O)N1CCc2c(C1)cc(c(c2)OC)OC)C
STL537837
Synonyms: (12bS)-9-fluoro-12b-methyl-2-(3,4,5-trimethoxybenzyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(CN2CC(=O)N3[C@@](C2=O)(C)c2[nH]c4c(c2CC3)cc(cc4)F)cc(c1OC)OC
STL537838
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-methionyl]piperidin-4-yl}carbonyl)glycine
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)NCC(=O)O)NC(=O)OC(C)(C)C
STL537839
Synonyms: (12aS)-2-[2-(cyclohex-1-en-1-yl)ethyl]-6-(2,3-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCC1=CCCCC1
STL537840
Synonyms: (12bS)-9-fluoro-2-[2-(4-fluorophenyl)ethyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Fc1ccc(cc1)CCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)F
STL537841
Synonyms: 7-[(4-bromo-2-fluorobenzyl)oxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4-methyl-2H-chromen-2-one
Smiles: Brc1ccc(c(c1)F)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCC2(C(C1)CCCC2)O
STL537842
Synonyms: N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-D-leucine
Smiles: CC(C[C@H](C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C)C
STL537843
Synonyms: S-benzyl-N-[3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-D-cysteine
Smiles: O=C(N[C@@H](C(=O)O)CSCc1ccccc1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C
STL537844
Synonyms: methyl4-{(12aS)-2-[2-(4-chlorophenyl)ethyl]-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-6-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccc(cc1)Cl
STL537845
Synonyms: 4-chloro-N-[(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]phenylalanine
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)NC(C(=O)O)Cc1ccc(cc1)Cl
STL537846
Synonyms: 1-({1-[N-(tert-butoxycarbonyl)-L-phenylalanyl]piperidin-4-yl}carbonyl)-L-proline
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N1CCC[C@H]1C(=O)O)Cc1ccccc1
STL537847
Synonyms: S-methyl-N-[(1-{N-[(4-methylphenyl)sulfonyl]-L-alanyl}piperidin-4-yl)carbonyl]-L-cysteine
Smiles: CSC[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)C)C
STL537848
Synonyms: N~2~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-(pyridin-4-ylmethyl)-L-valinamide
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)NCc1ccncc1)C(C)C
STL537849
Synonyms: (1'R,2'R)-1'-(phenylcarbonyl)-2'-(3,4,5-trimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cc(cc(c1OC)OC)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL537850
Synonyms: 3-benzyl-7-{2-[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-2-oxoethoxy}-4,8-dimethyl-2H-chromen-2-one
Smiles: O=C(N1CC[C@@]2([C@H](C1)CCCC2)O)COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1
STL537851
Synonyms: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(3,4,9-trimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl)acetamide
Smiles: CCN1CCCC1CNC(=O)Cc1c(=O)oc2c(c1C)c1occ(c1c(c2)C)C
STL537852
Synonyms: 7-[2-(1-butyl-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-6-methyl-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Smiles: CCCCC1N(CCC2(C1CCCC2)O)C(=O)COc1ccc2c(c1C)oc(=O)c1c2CCC1
STL537853
Synonyms: S-benzyl-N-[(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-D-cysteine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)N[C@@H](C(=O)O)CSCc1ccccc1
STL537854
Synonyms: (12bR)-2-{[(E)-(2,4-dimethoxyphenyl)methylidene]amino}-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(c(c1)OC)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537855
Synonyms: 6,7-dimethoxy-3-[2-oxo-2-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)ethyl]quinazolin-4(3H)-one
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N1CC2(CC1CC(C2)(C)C)C
STL537856
Synonyms: methyl4-[(12aS)-1,4-dioxo-2-(tetrahydrofuran-2-ylmethyl)-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-6-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CC1CCCO1
STL537857
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(pyridin-2-ylmethyl)benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1ccccn1
STL537858
Synonyms: (2S)-N-heptyl-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamide
Smiles: CCCCCCCNC(=O)[C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C
STL537859
Synonyms: (1'R,2'R)-1'-acetyl-2'-(2,5-dimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1)OC
STL537860
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-1-[(4-fluorophenyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-methyl-1-oxopentan-2-yl}carbamate
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)F)C(C)C)NC(=O)OC(C)(C)C)C
STL537861
Synonyms: (12aS)-6-(4-chlorophenyl)-2-cyclooctyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCCCC1
STL537862
Synonyms: 3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-pentylbenzamide
Smiles: CCCCCNC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537863
Synonyms: (12aS)-6-(4-methoxyphenyl)-2-(3-phenylpropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCc1ccccc1
STL537864
Synonyms: (12aS)-2-cycloheptyl-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCCC1
STL537865
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-1-[(4-fluorobenzyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-methyl-1-oxopentan-2-yl}carbamate
Smiles: CC([C@@H](C(=O)NCc1ccc(cc1)F)NC(=O)C1CCN(CC1)C(=O)[C@@H](NC(=O)OC(C)(C)C)CC(C)C)C
STL537866
Synonyms: (12aS)-2-(4-chlorobenzyl)-6-(naphthalen-1-yl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(cc1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc3c2cccc3)[nH]c2c1cccc2
STL537867
Synonyms: (1'R,2'R)-1'-acetyl-2'-(3,4,5-trimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1c(OC)cc(cc1OC)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL537868
Synonyms: (12aS)-2-cyclopropyl-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CC1
STL537869
Synonyms: N-[(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]-D-methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)OC
STL537870
Synonyms: 2-(4-methoxyphenyl)-2-oxoethyl4,6-di-O-acetyl-2,3-di-O-prop-1-en-2-yl-1-thio-beta-D-glucopyranoside
Smiles: COc1ccc(cc1)C(=O)CS[C@@H]1O[C@H](COC(=O)C)[C@H]([C@@H]([C@H]1OC(=C)C)OC(=C)C)OC(=O)C
STL537871
Synonyms: 4-chlorophenyl2-(acetylamino)-2-deoxy-4,6-O-(furan-2-ylmethylidene)-beta-D-glucopyranoside
Smiles: CC(=O)N[C@H]1[C@@H](O[C@H]2[C@H]([C@@H]1O)OC(OC2)c1ccco1)Oc1ccc(cc1)Cl
STL537872
Synonyms: methyl4-({[4-(pyridin-3-yl)-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)N1CCc2c(C1c1cccnc1)[nH]cn2
STL537873
Synonyms: 7-[(4-bromobenzyl)oxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4-methyl-2H-chromen-2-one
Smiles: Brc1ccc(cc1)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCC2(C(C1)CCCC2)O
STL537874
Synonyms: N-{(2S)-1-[(1,3-benzodioxol-5-ylmethyl)amino]-3-methyl-1-oxobutan-2-yl}-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)N[C@H](C(=O)NCc1ccc2c(c1)OCO2)C(C)C
STL537875
Synonyms: N-(4-fluorobenzyl)-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: Fc1ccc(cc1)CNC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537876
Synonyms: (12aS)-6-(2,5-dimethoxyphenyl)-2-(thiophen-2-ylmethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1cccs1)OC
STL537877
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-1-[(4-ethylphenyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)CC)C(C)C)NC(=O)OC(C)(C)C
STL537878
Synonyms: 4-chloro-N-[(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]phenylalanine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C)NC(C(=O)O)Cc1ccc(cc1)Cl
STL537879
Synonyms: 8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-ylN-(tert-butoxycarbonyl)-5-methyl-D-norleucinate
Smiles: COc1ccc2c(c1)c(=O)oc1c2ccc(c1C)OC(=O)[C@H](NC(=O)OC(C)(C)C)CCC(C)C
STL537880
Synonyms: N-(4-methylcyclohexyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CC1CCC(CC1)NC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537881
Synonyms: N-[2-(4-methoxyphenyl)ethyl]-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc(cc1)CCNC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537882
Synonyms: N-benzyl-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1ccccc1
STL537883
Synonyms: N-{[(4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}norleucine
Smiles: CCCCC(C(=O)O)NC(=O)COc1ccc2c(c1C)oc(=O)cc2CC
STL537884
Synonyms: N-cycloheptyl-4-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccc(cc1)C(=O)NC1CCCCCC1
STL537885
Synonyms: 3-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4,8-dimethyl-7-[(4-methylbenzyl)oxy]-2H-chromen-2-one
Smiles: Cc1ccc(cc1)COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)N1CCC2(C(C1)CCCC2)O
STL537886
Synonyms: N-[4-(acetylamino)phenyl]-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CC(=O)Nc1ccc(cc1)NC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537887
Synonyms: (3aS,6R,7R,7aS)-N-(furan-2-ylmethyl)-2-[2-(1H-indol-3-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: O=C([C@H]1[C@@H]2C=C[C@@]3([C@H]1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2)NCc1ccco1
STL537888
Synonyms: methylN-{[4-(3-methylbutoxy)phenyl]carbonyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)c1ccc(cc1)OCCC(C)C
STL537889
Synonyms: 2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-[3-(morpholin-4-yl)propyl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCCCN1CCOCC1
STL537890
Synonyms: (12bS)-2-(1-benzylpiperidin-4-yl)-9-methoxy-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)C1CCN(CC1)Cc1ccccc1
STL537891
Synonyms: N-{2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]propanoyl}glycine
Smiles: OC(=O)CNC(=O)C(Oc1cc(C)cc2c1c(C)c(c(=O)o2)C)C
STL537892
Synonyms: (1S,5S)-N-{(2S)-1-[(3,4-difluorophenyl)amino]-3-methyl-1-oxobutan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)N[C@H](C(=O)Nc1ccc(c(c1)F)F)C(C)C
STL537893
Synonyms: (12aS)-6-(2,5-dimethoxyphenyl)-2-[3-(1H-imidazol-1-yl)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(c(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCn1ccnc1)OC
STL537894
Synonyms: N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]norleucine
Smiles: CCCCC(C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C
STL537895
Synonyms: (12aS)-2-[2-(cyclohex-1-en-1-yl)ethyl]-6-(2,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(OC)ccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCC1=CCCCC1
STL537896
Synonyms: (12bS)-2-(3,4-dimethoxybenzyl)-9-methoxy-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)Cc1ccc(c(c1)OC)OC
STL537897
Synonyms: (3aS,6R,7R,7aS)-N-(3,4-dimethoxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)[C@H]1[C@@H]2C=C[C@@]3([C@H]1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2
STL537898
Synonyms: (12aS)-6-(3,4-dimethoxyphenyl)-2-[2-(4-methoxyphenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(c(c2)OC)OC)[nH]c2c1cccc2
STL537899
Synonyms: 7-{2-[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-2-oxoethoxy}-6-methyl-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Smiles: O=C(N1CC[C@@]2([C@H](C1)CCCC2)O)COc1ccc2c(c1C)oc(=O)c1c2CCC1
STL537900
Synonyms: 7-[(4-chlorobenzyl)oxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4,8-dimethyl-2H-chromen-2-one
Smiles: Clc1ccc(cc1)COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)N1CCC2(C(C1)CCCC2)O
STL537901
Synonyms: (12bS)-2-[2-(2-fluorophenyl)ethyl]-9-methoxy-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)CCc1ccccc1F
STL537902
Synonyms: (12bS)-9-methoxy-12b-methyl-2-(tetrahydrofuran-2-ylmethyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)CC1CCCO1
STL537903
Synonyms: (12aS)-2-(4-chlorobenzyl)-6-(3,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(cc1)Cl
STL537904
Synonyms: 1-({1-[N-(tert-butoxycarbonyl)-L-alanyl]piperidin-4-yl}carbonyl)-L-proline
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N1CCC[C@H]1C(=O)O)C
STL537905
Synonyms: (12aS)-2-(5-hydroxypentyl)-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: OCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C(C)C)[nH]c2c1cccc2
STL537906
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,4-dimethylphenyl)-5-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(C)cc2
STL537907
Synonyms: (12aS)-6-(2-ethoxyphenyl)-2-propyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OCC)[nH]c2c1cccc2
STL537908
Synonyms: tert-butyl{(2S)-3-methyl-1-[4-({(2S)-1-[(4-methylbenzyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-1-oxobutan-2-yl}carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)C)C)C(C)C
STL537909
Synonyms: (6S,6aR,13R,13aS)-N-(naphthalen-1-yl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carboxamide
Smiles: O=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Nc1cccc2c1cccc2
STL537910
Synonyms: (12bS)-9-methoxy-2-(3-methoxybenzyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)CN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL537911
Synonyms: (11bS)-2-(3-acetylphenyl)-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: CC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537912
Synonyms: [4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl](3,4,5-triethoxyphenyl)methanone
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)N1CCC2(C(C1c1ccccc1OC)CCCC2)O
STL537913
Synonyms: methyl4-[(E)-{[(12aS)-6,6-dimethyl-1,4-dioxo-3,4,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-2(1H)-yl]imino}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/N1CC(=O)N2[C@H](C1=O)Cc1c(C2(C)C)[nH]c2c1cccc2
STL537914
Synonyms: (12aS)-2-(1-benzylpiperidin-4-yl)-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCN(CC1)Cc1ccccc1
STL537915
Synonyms: 1-deoxy-1-{methyl[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]amino}hexitol
Smiles: CN(C(=O)Cc1c(C)c2cc3c(C)c(oc3c(c2oc1=O)C)C)CC(C(C(C(CO)O)O)O)O
STL537917
Synonyms: (12aS)-6-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)Cl)[nH]c2c1cccc2
STL537918
Synonyms: N-[3-(dibutylamino)propyl]-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCN(CCCC)CCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL537919
Synonyms: (12aS)-2-{[(E)-(2-chlorophenyl)methylidene]amino}-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1N(/N=C/c2ccccc2Cl)CC(=O)N2[C@H]1Cc1c3ccccc3[nH]c1C2(C)C
STL537920
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NC1CC(C)(C)NC(C1)(C)C
STL537921
Synonyms: S-benzyl-N-[3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]-D-cysteine
Smiles: O=C(N[C@@H](C(=O)O)CSCc1ccccc1)CCc1c(=O)oc2c(c1C)ccc(c2)O
STL537922
Synonyms: 7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-ylN-(tert-butoxycarbonyl)-D-valinate
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C(C)C
STL537923
Synonyms: (2Z)-N-hydroxy-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3-(4-methoxyphenyl)propan-2-imine
Smiles: O/N=C(\CC1N(C)CCc2c1c(OC)c1c(c2)OCO1)/Cc1ccc(cc1)OC
STL537924
Synonyms: (5aR,5bR,7aR,11bR,13bR)-5a,5b,10,10,13b-pentamethyloctadecahydro-11,7a-(epoxymethano)cyclopenta[a]chrysen-3(3aH)-one
Smiles: O=C1CC[C@]2(C1CC[C@@]1(C2CC[C@H]2[C@@]1(C)CC[C@@]13C2C(OC1)C(CC3)(C)C)C)C
STL537925
Synonyms: N-(5-bromo-1-ethyl-2-oxo-2,3-dihydro-1H-indol-3-yl)-N'-[2-(5-methoxy-1H-indol-3-yl)ethyl]ethanediamide
Smiles: CCN1C(=O)C(c2c1ccc(c2)Br)NC(=O)C(=O)NCCc1c[nH]c2c1cc(OC)cc2
STL537926
Synonyms: bis(2-methylpropyl)4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Smiles: COc1cc(ccc1O)C1C(C(=O)OCC(C)C)C(=O)CC(C1C(=O)OCC(C)C)(C)O
STL537927
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-methionyl]piperidin-4-yl}carbonyl)-L-tryptophan
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)NC(=O)OC(C)(C)C
STL537928
Synonyms: N-[(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine
Smiles: CC[C@H]([C@@H](C(=O)O)NC(=O)CNC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)O)C
STL537929
Synonyms: N-[2-(3-chlorophenyl)ethyl]-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: Clc1cccc(c1)CCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537930
Synonyms: (12aS)-2-(3-butoxypropyl)-6-(2,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCOCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2OC)OC)[nH]c2c1cccc2
STL537931
Synonyms: [3-acetyl-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]aceticacid
Smiles: COc1cc(ccc1O)C1N(CC(=O)O)C(=O)C(=C1C(=O)C)O
STL537932
Synonyms: 4-({[(1-{N-[(4-methylphenyl)sulfonyl]-L-valyl}piperidin-4-yl)carbonyl]amino}methyl)cyclohexanecarboxylicacid
Smiles: Cc1ccc(cc1)S(=O)(=O)N[C@H](C(=O)N1CCC(CC1)C(=O)NCC1CCC(CC1)C(=O)O)C(C)C
STL537933
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCc1ccc2c(c1)OCO2
STL537934
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-tryptophyl]piperidin-4-yl}carbonyl)-L-phenylalanine
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc1c[nH]c2c1cccc2
STL537935
Synonyms: (3aS,6R,7R,7aS)-N-cyclopropyl-2-[2-(1H-indol-3-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: O=C([C@H]1[C@@H]2C=C[C@@]3([C@H]1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2)NC1CC1
STL537936
Synonyms: (12aS)-6-(2-ethoxyphenyl)-2-(furan-2-ylmethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccco1
STL537937
Synonyms: (12bR)-12b-methyl-2-{[(E)-(2-methylphenyl)methylidene]amino}-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Cc1ccccc1/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537938
Synonyms: N-({1-[N-(tert-butoxycarbonyl)glycyl]piperidin-4-yl}carbonyl)-L-tyrosine
Smiles: O=C(OC(C)(C)C)NCC(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O
STL537939
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,4-dimethylphenyl)-6,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1ccc(c2C)C
STL537940
Synonyms: 2,2-dimethyl-3-[methyl(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl)carbamoyl]cyclopropanecarboxylicacid
Smiles: O=C1Nc2ccccc2CCC1N(C(=O)C1C(C1(C)C)C(=O)O)C
STL537941
Synonyms: methylN-{[4-(pyridin-4-yl)-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}glycinate
Smiles: COC(=O)CNC(=O)N1CCc2c(C1c1ccncc1)[nH]cn2
STL537942
Synonyms: (12aS)-2-(2-chlorobenzyl)-6-(3,4,5-trimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1Cl
STL537943
Synonyms: N~2~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-(3-hydroxyphenyl)-L-alaninamide
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)Nc1cccc(c1)O)C
STL537945
Synonyms: methyl4-{(12aS)-2-[3-(morpholin-4-yl)propyl]-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-6-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCN1CCOCC1
STL537946
Synonyms: (12aS)-2-[2-(morpholin-4-yl)ethyl]-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(CCN2CCOCC2)C(=O)[C@H]2N1C(c1ccc(cc1)C(C)C)c1c(C2)c2c([nH]1)cccc2
STL537947
Synonyms: 2-butyl-6-(4-chlorophenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCN1CC(=O)N2C(C1=O)Cc1c(C2c2ccc(cc2)Cl)[nH]c2c1cccc2
STL537948
Synonyms: (12aS)-2-{[(E)-(2-methylphenyl)methylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1N(/N=C/c2ccccc2C)CC(=O)N2[C@H]1Cc1c(C2)[nH]c2c1cccc2
STL537949
Synonyms: (12aS)-2-(2-chlorobenzyl)-6-(4-ethoxy-3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccc(cc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1Cl
STL537951
Synonyms: (12aS)-2-(2,2-diphenylethyl)-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CC(c1ccccc1)c1ccccc1
STL537952
Synonyms: N-[(2S)-1-(3,4-dihydroisoquinolin-2(1H)-yl)-1-oxopropan-2-yl]-2-(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetamide
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)N1CCc2c(C1)cccc2)C
STL537953
Synonyms: (12aS)-6-(2-ethoxyphenyl)-2-hexyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OCC)[nH]c2c1cccc2
STL537954
Synonyms: N-(heptan-2-yl)-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCCC(NC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C
STL537955
Synonyms: 5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-2,6-dioxo-3-(prop-2-en-1-yl)-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: C=CCn1c(=O)[nH]c(=O)c(c1[O-])C1[NH+](C)CCc2c1c(OC)c1c(c2)OCO1
STL537956
Synonyms: (12aS)-6-(2,4-dimethoxyphenyl)-2-propyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2OC)OC)[nH]c2c1cccc2
STL537957
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-1-[(4-fluorobenzyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)F)C(C)C)NC(=O)OC(C)(C)C
STL537958
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzohydrazide
Smiles: NNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537959
Synonyms: (12aS)-6-(4-methylphenyl)-2-(2-methylpropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CC(CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C)[nH]c2c1cccc2)C
STL537960
Synonyms: N-(3-ethylphenyl)-4-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccc(cc1)C(=O)Nc1cccc(c1)CC
STL537961
Synonyms: (12aS)-6-(2,4-dimethoxyphenyl)-2-(furan-2-ylmethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(OC)ccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccco1
STL537962
Synonyms: (1S,5S)-N-{(2S)-1-[(4-methylphenyl)amino]-1-oxo-3-phenylpropan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1ccccc1
STL537963
Synonyms: 2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(6-methylheptan-2-yl)benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NC(CCCC(C)C)C
STL537964
Synonyms: N-(3,4-dimethoxybenzyl)-1-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-5-oxo-L-prolinamide
Smiles: COc1ccc(cc1OC)CNC(=O)[C@@H]1CCC(=O)N1C1OC(=O)c2c1ccc(c2OC)OC
STL537965
Synonyms: 2-(2-chlorobenzyl)-1-(2-ethoxyphenyl)octahydroisoquinolin-4a(2H)-ol
Smiles: CCOc1ccccc1C1N(CCC2(C1CCCC2)O)Cc1ccccc1Cl
STL537967
Synonyms: 3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(1-phenylethyl)benzamide
Smiles: O=C(c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NC(c1ccccc1)C
STL537968
Synonyms: N~5~-carbamoyl-N~2~-[(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]-D-ornithine
Smiles: Cc1c(CC(=O)N[C@@H](C(=O)O)CCCNC(=O)N)c(=O)oc2c1ccc(c2C)OC
STL537969
Synonyms: 3-[(5s,7s)-2-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-5,7-dimethyl-6-oxo-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl]propanenitrile
Smiles: N#CCCC1(N2C[C@]3(CN1C[C@@](C2)(C3=O)C)C)C1CCOC(C1)(C)C
STL537970
Synonyms: (3aS,6R,7R,7aS)-2-[2-(1H-indol-3-yl)ethyl]-N-(2-methoxybenzyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1ccccc1CNC(=O)[C@H]1[C@@H]2C=C[C@@]3([C@H]1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2
STL537971
Synonyms: N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-D-isoleucine
Smiles: CC[C@@H]([C@H](C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C)C
STL537972
Synonyms: 4-chloro-N-[(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]phenylalanine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2)NC(C(=O)O)Cc1ccc(cc1)Cl
STL537973
Synonyms: (1S,5S)-N-{(2S)-1-[(4-fluorophenyl)amino]-3-methyl-1-oxobutan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)[C@H](C(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL537974
Synonyms: (1S,5S)-N-{(2S)-1-[(3-fluorophenyl)amino]-1-oxo-3-phenylpropan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: Fc1cccc(c1)NC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1ccccc1
STL537975
Synonyms: N-(4-hydroxy-1,1-dioxidotetrahydrothiophen-3-yl)-3-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}propanamide
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NC1CS(=O)(=O)CC1O
STL537976
Synonyms: (12bS)-2-[2-(4-fluorophenyl)ethyl]-9-methoxy-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)CCc1ccc(cc1)F
STL537977
Synonyms: 6-chloro-4-ethyl-2-oxo-2H-chromen-7-ylN-[(4-methylphenyl)sulfonyl]-L-phenylalaninate
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1
STL537978
Synonyms: (12aS)-2-cyclohexyl-6-(4-ethoxy-3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccc(cc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCC1
STL537979
Synonyms: (12aS)-6-(2,5-dimethoxyphenyl)-2-(2-methoxyethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cc(OC)ccc2OC)[nH]c2c1cccc2
STL537980
Synonyms: (3E)-4-(1H-indol-3-yl)-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)but-3-en-2-one
Smiles: COc1c2c(CCN(C2CC(=O)/C=C/c2c[nH]c3c2cccc3)C)cc2c1OCO2
STL537981
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(4-acetylphenyl)-5-bromo-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Brc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C(=O)C
STL537982
Synonyms: N~2~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-(4-hydroxyphenyl)-L-valinamide
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)Nc1ccc(cc1)O)C(C)C
STL537983
Synonyms: (11aS)-2-(2-ethylphenyl)-5-(4-methylphenyl)-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: CCc1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1ccc(cc1)C)c1c(C2)c2ccccc2[nH]1
STL537984
Synonyms: (12aS)-6-(3-bromophenyl)-2-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Brc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccccc1
STL537985
Synonyms: [4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl](9H-xanthen-9-yl)methanone
Smiles: COc1ccccc1C1N(CCC2(C1CCCC2)O)C(=O)C1c2ccccc2Oc2c1cccc2
STL537986
Synonyms: N-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-L-alanine
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)O)C
STL537987
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-[2-(morpholin-4-yl)ethyl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCCN1CCOCC1
STL537988
Synonyms: (12aS)-6-(2,3-dimethoxyphenyl)-2-[3-(morpholin-4-yl)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCN1CCOCC1
STL537989
Synonyms: N-(furan-2-ylmethyl)-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1ccco1
STL537990
Synonyms: (3S,11E)-16-hydroxy-3-methyl-14-[(4-methylbenzyl)oxy]-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione
Smiles: O=C1CCC/C=C/c2cc(OCc3ccc(cc3)C)cc(c2C(=O)O[C@H](CCC1)C)O
STL537991
Synonyms: (12aS)-6-(3-methoxyphenyl)-2-[3-(morpholin-4-yl)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCN1CCOCC1
STL537992
Synonyms: (12aS)-2-(3-phenylpropyl)-6-(3,4,5-trimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1c(OC)cc(cc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCc1ccccc1
STL537993
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-leucyl]piperidin-4-yl}carbonyl)-N-methylglycine
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N(CC(=O)O)C)NC(=O)OC(C)(C)C)C
STL537994
Synonyms: (12aS)-2-[2-(1H-indol-3-yl)ethyl]-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1c[nH]c2c1cccc2
STL537995
Synonyms: N-(3-ethoxypropyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCOCCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL537996
Synonyms: N-{2-[3-(1,2-dimethyl-1H-indol-3-yl)-2,2-dimethylcyclopropyl]ethyl}benzamide
Smiles: O=C(c1ccccc1)NCCC1C(C1(C)C)c1c2ccccc2n(c1C)C
STL537997
Synonyms: 4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl2-{[(4-methylphenyl)sulfonyl]amino}butanoate
Smiles: CCC(C(=O)Oc1ccc2c(c1)oc(=O)cc2c1ccc(cc1)OC)NS(=O)(=O)c1ccc(cc1)C
STL537998
Synonyms: (12aS)-2-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-6-phenyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1OC)/C=N/N1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2)[nH]c2c1cccc2
STL537999
Synonyms: N-[(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]-D-methionine
Smiles: Cc1c(CC(=O)N[C@@H](C(=O)O)CCSC)c(=O)oc2c1ccc(c2C)O
STL538000
Synonyms: (3aR,6S,7aS)-N-(2,4-dimethoxyphenyl)-2-(furan-2-ylmethyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1cc(OC)ccc1NC(=O)C1[C@H]2C=C[C@]3([C@H]1C(=O)N(C3)Cc1ccco1)O2
STL538001
Synonyms: (1Z)-1-(6-tert-butyl-1,1-dimethyl-2,3-dihydro-1H-inden-4-yl)-N-hydroxy-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanimine
Smiles: O/N=C(\c1cc(cc2c1CCC2(C)C)C(C)(C)C)/CC1N(C)CCc2c1c(OC)c1c(c2)OCO1
STL538003
Synonyms: (1S,5S)-N-{(2S)-1-[(3-chloro-4-methylphenyl)amino]-1-oxo-3-phenylpropan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)N[C@H](C(=O)Nc1ccc(c(c1)Cl)C)Cc1ccccc1
STL538004
Synonyms: N-[(6'-methyl-8'-oxo-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-7'-yl)acetyl]glycyl-L-valine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2)NCC(=O)N[C@H](C(=O)O)C(C)C
STL538005
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-1-[(4-fluorobenzyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)F)C)NC(=O)OC(C)(C)C
STL538006
Synonyms: N-methyl-N-[(1-{N-[(4-methylphenyl)sulfonyl]-L-leucyl}piperidin-4-yl)carbonyl]glycine
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N(CC(=O)O)C)NS(=O)(=O)c1ccc(cc1)C)C
STL538007
Synonyms: 6-chloro-2-oxo-4-phenyl-2H-chromen-7-ylN-[(4-methylphenyl)sulfonyl]-L-isoleucinate
Smiles: CC[C@H]([C@@H](C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)C
STL538008
Synonyms: (1'R,2'R)-2'-(2-ethoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: CCOc1ccccc1[C@H]1[C@H](C(=O)c2cccc(c2)OC)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STL538009
Synonyms: 2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-[3-(propan-2-yloxy)propyl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCCCOC(C)C
STL538010
Synonyms: (1'R,2'R)-2'-(3-methoxyphenyl)-8'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cc(C)cc1
STL538011
Synonyms: 5-oxo-1-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)-N-(2-phenylethyl)-L-prolinamide
Smiles: O=C([C@@H]1CCC(=O)N1C1OC(=O)c2c1cccc2)NCCc1ccccc1
STL538012
Synonyms: (12bR)-12b-methyl-2-{[(E)-thiophen-2-ylmethylidene]amino}-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(/N=C/c2cccs2)C(=O)[C@@]2(N1CCc1c2[nH]c2c1cccc2)C
STL538014
Synonyms: (12aS)-2-[2-(cyclohex-1-en-1-yl)ethyl]-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(CCC2=CCCCC2)C(=O)[C@H]2N1C(c1ccc(cc1)C(C)C)c1c(C2)c2c([nH]1)cccc2
STL538015
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-tryptophyl]piperidin-4-yl}carbonyl)-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)OC(C)(C)C
STL538016
Synonyms: N-hexyl-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL538017
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-methyl-2-[(4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)C)COc1cc2OC(C)(C)CCc2c2c1c(C)cc(=O)o2
STL538018
Synonyms: N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-D-tyrosine
Smiles: O=C(N[C@@H](C(=O)O)Cc1ccc(cc1)O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C
STL538019
Synonyms: 3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-[3-(propan-2-yloxy)propyl]benzamide
Smiles: CC(OCCCNC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C
STL538020
Synonyms: (12aS)-2-(1-benzylpiperidin-4-yl)-6-(3,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCN(CC1)Cc1ccccc1
STL538021
Synonyms: 6-chloro-2-oxo-4-propyl-2H-chromen-7-ylN-(tert-butoxycarbonyl)-D-phenylalaninate
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C
STL538022
Synonyms: (3S,6aR,6bR,12R,12bR,14bR)-4,4,6a,6b,14b-pentamethyl-12-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,6a,6b,7,8,10,11,12,12a,12b,13,14,14a,14b-icosahydropicen-3-ylacetate
Smiles: CC(=O)O[C@H]1CC[C@]2(C(C1(C)C)CC[C@@]1(C2CC[C@H]2[C@@]1(C)CCC1=CCC[C@H](C21)C(=C)C)C)C
STL538023
Synonyms: (12aS)-2-butyl-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OCC)[nH]c2c1cccc2
STL538024
Synonyms: (1'S,2'S,3R,3a'R)-2'-[(2,5-dimethoxyphenyl)carbonyl]-5'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=C(c1c2cccc1)C)OC
STL538025
Synonyms: 3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4-methyl-7-(naphthalen-1-ylmethoxy)-2H-chromen-2-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)ccc(c2)OCc1cccc2c1cccc2
STL538026
Synonyms: (12aS)-6-(3,4-dimethoxyphenyl)-2-(2-methylpropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CC(C)C
STL538027
Synonyms: (12aS)-6-(3-methoxyphenyl)-2-[2-(4-methoxyphenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)OC)[nH]c2c1cccc2
STL538028
Synonyms: 2-{[(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]amino}butanoicacid
Smiles: CCC(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C
STL538029
Synonyms: (1S,5S)-N-[(2S)-1-[(4-butoxyphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: CCCCOc1ccc(cc1)NC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)CCSC
STL538030
Synonyms: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCCC1=CCCCC1
STL538031
Synonyms: N-butyl-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCNC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL538032
Synonyms: N-{[(2,2-dimethyl-6-oxo-3,4,7,8,9,10-hexahydro-2H,6H-benzo[c]pyrano[2,3-h]chromen-11-yl)oxy]acetyl}-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)COc1cc2OC(C)(C)CCc2c2c1c1CCCCc1c(=O)o2
STL538033
Synonyms: (3aR,6S,7aS)-2-[4-(acetylamino)phenyl]-1-oxo-N-(3,4,5-trimethoxyphenyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1cc(NC(=O)C2[C@H]3C=C[C@]4([C@H]2C(=O)N(C4)c2ccc(cc2)NC(=O)C)O3)cc(c1OC)OC
STL538034
Synonyms: methyl(1'R,2'R)-2'-(3-methoxyphenyl)-1,3-dioxo-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate
Smiles: COC(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1cccc(c1)OC)C(=O)c1c(C2=O)cccc1
STL538035
Synonyms: (12aS)-6-(4-methylphenyl)-2-propyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C)[nH]c2c1cccc2
STL538036
Synonyms: (12aS)-6-(3-methoxyphenyl)-2-[3-(propan-2-yloxy)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCOC(C)C
STL538037
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxy-5-methylphenyl)-3-phenylpropanamide
Smiles: COc1cc(CCNC(=O)CC(c2cc(C)ccc2O)c2ccccc2)ccc1OC
STL538038
Synonyms: N-{[(4-butyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-L-leucine
Smiles: CCCCc1cc(=O)oc2c1ccc(c2C)OCC(=O)N[C@H](C(=O)O)CC(C)C
STL538039
Synonyms: (1S,5S)-N-{(2S)-1-[(3-methoxypropyl)amino]-1-oxo-3-phenylpropan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: COCCCNC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1ccccc1
STL538040
Synonyms: 6,7-dimethoxy-N-{(2S)-1-[(3-methoxyphenyl)amino]-1-oxopropan-2-yl}-1-phenyl-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: COc1cccc(c1)NC(=O)[C@@H](NC(=O)N1CCc2c(C1c1ccccc1)cc(c(c2)OC)OC)C
STL538041
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(3,4-dimethylphenyl)-6,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2ccc(c(c2)C)C)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1ccc(c2C)C
STL538042
Synonyms: (12aS)-6-(3-bromophenyl)-2-(4-methoxybenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)Br)[nH]c2c1cccc2
STL538043
Synonyms: (12aS)-2-cyclooctyl-6-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(C2CCCCCCC2)C(=O)[C@H]2N1C(CCc1ccccc1)c1c(C2)c2c([nH]1)cccc2
STL538044
Synonyms: 2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-octylbenzamide
Smiles: CCCCCCCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL538045
Synonyms: N-[(2S)-1-hydroxypropan-2-yl]-3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxamide
Smiles: OC[C@@H](NC(=O)c1cccc2c1oc(c1ccccc1)c(c2=O)C)C
STL538046
Synonyms: (12aS)-6-(4-bromophenyl)-2-[3-(propan-2-yloxy)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CC(OCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)Br)[nH]c2c1cccc2)C
STL538047
Synonyms: (1S,5S)-N-{(2S)-1-[(3-fluorophenyl)amino]-3-methyl-1-oxobutan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: Fc1cccc(c1)NC(=O)[C@H](C(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL538048
Synonyms: 5-[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline
Smiles: COc1c2OCOc2cc2c1C(N(CC2)C)c1nnnn1c1ccc(cc1C)C
STL538049
Synonyms: N-[3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]-D-isoleucine
Smiles: CC[C@@H]([C@H](C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)O)C
STL538050
Synonyms: N-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2-[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(COc1ccc2c(c1C)oc(=O)c(c2C)C)NCCC(=O)N1CCC2(C(C1)CCCC2)O
STL538051
Synonyms: N-(3-methoxyphenyl)-5-oxo-1-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)-L-prolinamide
Smiles: COc1cccc(c1)NC(=O)[C@@H]1CCC(=O)N1C1OC(=O)c2c1cccc2
STL538052
Synonyms: N-cyclooctyl-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NC1CCCCCCC1
STL538053
Synonyms: N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]propanamide
Smiles: O=C(CC[C@H]1NC(=O)c2c(NC1=O)cccc2)NCCSc1ccc(cc1)Cl
STL538054
Synonyms: (3R,11E)-14-[(4-bromobenzyl)oxy]-16-hydroxy-3-methyl-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione
Smiles: O=C1CCC/C=C/c2cc(OCc3ccc(cc3)Br)cc(c2C(=O)O[C@@H](CCC1)C)O
STL538055
Synonyms: (1S,5S)-N-[(2S)-1-(cyclohexylamino)-1-oxo-3-phenylpropan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)N[C@H](C(=O)NC1CCCCC1)Cc1ccccc1
STL538056
Synonyms: 1-butan-2-yl-3-(2-{6-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)thiourea
Smiles: CCC(NC(=S)NCCc1cc2OCOc2c(c1C=C1C(=O)N(C)C(=O)N(C1=O)C)OC)C
STL538057
Synonyms: (12aS)-6-(2,5-dimethoxyphenyl)-2-(2-fluorobenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(c(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1F)OC
STL538058
Synonyms: (12aS)-6-(2,3-dimethoxyphenyl)-2-(3-propoxypropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCOCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2OC)OC)[nH]c2c1cccc2
STL538059
Synonyms: (12bR)-2-{[(E)-(2-chlorophenyl)methylidene]amino}-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccccc1/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL538060
Synonyms: 4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-[3-(propan-2-yloxy)propyl]benzamide
Smiles: CC(OCCCNC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C
STL538061
Synonyms: (1S,5S)-N-[(2S)-1-[(3,5-dimethoxyphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1cc(OC)cc(c1)OC)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL538062
Synonyms: (12aS)-2-(2-methoxybenzyl)-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OC)[nH]c2c1cccc2
STL538063
Synonyms: (8xi,9xi,14xi)-3-oxoandrost-4-en-17-yl4-[(2,5-dioxopyrrolidin-1-yl)oxy]-4-oxobutanoate
Smiles: O=C(OC1CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C)CCC(=O)ON1C(=O)CCC1=O
STL538064
Synonyms: (12aS)-2-benzyl-6-(3,4-dimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1
STL538065
Synonyms: (12aS)-2-(4-methoxybenzyl)-6-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2C)[nH]c2c1cccc2
STL538066
Synonyms: 3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(tetrahydrofuran-2-ylmethyl)benzamide
Smiles: O=C(c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCC1CCCO1
STL538067
Synonyms: N-(4-hydroxy-1,1-dioxidotetrahydrothiophen-3-yl)-2-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)NC1CS(=O)(=O)CC1O
STL538068
Synonyms: (12bR)-2-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Brc1ccc(c(c1)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)O
STL538069
Synonyms: (12aS)-2-butyl-6-(4-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C)[nH]c2c1cccc2
STL538070
Synonyms: (12aS)-2-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-6-phenyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(/C=N/N2CC(=O)N3[C@H](C2=O)Cc2c(C3c3ccccc3)[nH]c3c2cccc3)ccc1O
STL538071
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C)NC1CCOC(C1)(C)C
STL538072
Synonyms: (6S,6aR,13R,13aS)-N-(3-chloro-4-fluorophenyl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: S=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Nc1ccc(c(c1)Cl)F
STL538073
Synonyms: 2-[(3R,3'S,3a'S,6a'R)-5'-(4-bromophenyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: NC(=O)C[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)Br)C(=O)Nc1c2cccc1
STL538074
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1cc(CCNC(=O)c2ccc(cc2)N2C(=O)N3[C@@](C2=O)(C)c2[nH]c4c(c2CC3)cccc4)ccc1OC
STL538075
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-methionyl]piperidin-4-yl}carbonyl)-L-leucine
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)OC(C)(C)C
STL538076
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,3-dimethylphenyl)-6,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2cccc(c2C)C)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1ccc(c2C)C
STL538077
Synonyms: N-(2,3-dihydroxypropyl)-3-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)-N-methylpropanamide
Smiles: OCC(CN(C(=O)CCc1c(=O)oc2c(c1C)c(OC)cc1c2CCC(O1)(C)C)C)O
STL538078
Synonyms: N-cyclohexyl-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NC1CCCCC1
STL538079
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1ccc2c(c1)OCO2
STL538080
Synonyms: 1,7-dimethyl-8-(3,3,5-trimethylcyclohexyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC1CC(CC(C1)(C)C)n1c(C)cn2c1nc1c2c(=O)[nH]c(=O)n1C
STL538081
Synonyms: (12bS)-7-(2-chlorophenyl)-12b-methyl-2-propyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1ccccc1Cl)cccc3
STL538082
Synonyms: N-(3-methylbutyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CC(CCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C
STL538083
Synonyms: 2-{[(E)-(2-ethoxyphenyl)methylidene]amino}-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1/C=N/N1CC(=O)N2C(C1=O)Cc1c(C2(C)C)[nH]c2c1cccc2
STL538084
Synonyms: N-(2-chlorobenzyl)-4-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccc(cc1)C(=O)NCc1ccccc1Cl
STL538085
Synonyms: 5-hydroxy-N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]tryptophan
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C)NC(C(=O)O)Cc1c[nH]c2c1cc(O)cc2
STL538086
Synonyms: N-[6-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-6-oxohexyl]-2-[(2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetamide
Smiles: CCCc1cc(=O)oc2c1ccc(c2)OCC(=O)NCCCCCC(=O)N1CCC2(C(C1)CCCC2)O
STL538087
Synonyms: (1S,5S)-N-[(2S)-1-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-1-oxo-3-phenylpropan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)N[C@H](C(=O)NCCC1=CCCCC1)Cc1ccccc1
STL538088
Synonyms: (12bS)-2-hexyl-9-methoxy-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL538089
Synonyms: (12aS)-2-(4-methoxybenzyl)-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2C)[nH]c2c1cccc2
STL538090
Synonyms: 4-acetylphenyl(6aS,6bR,9aS,10R)-8-(1,3-benzodioxol-5-yl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: O=C([C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc3c(c1)OCO3)C=Cc1c2cccc1)Oc1ccc(cc1)C(=O)C
STL538091
Synonyms: (12aS)-6-(3-methylphenyl)-2-(2-methylpropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CC(CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)C)[nH]c2c1cccc2)C
STL538092
Synonyms: (12aS)-6-(2,5-dimethoxyphenyl)-2-(pyridin-3-ylmethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(c(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1cccnc1)OC
STL538093
Synonyms: 1-{[(3,4,8,8-tetramethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetyl}piperidine-3-carboxylicacid
Smiles: OC(=O)C1CCCN(C1)C(=O)COc1cc2OC(C)(C)CCc2c2c1c(C)c(c(=O)o2)C
STL538094
Synonyms: 4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-propylbenzamide
Smiles: CCCNC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL538095
Synonyms: (1'R,2'R)-8'-methyl-2'-phenyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Cc1ccc2c(c1)N1[C@@H](C(=O)c3ccccc3)[C@@H]([C@@]3(C1C=C2)C(=O)c1c(C3=O)cccc1)c1ccccc1
STL538096
Synonyms: N-(2,4-dimethoxybenzyl)-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: COc1ccc(c(c1)OC)CNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL538097
Synonyms: (3beta)-28-(4-benzylpiperazin-1-yl)-3-methylolean-12-en-28-one
Smiles: O=C([C@@]12CCC(C[C@H]2C2=CC[C@H]3[C@@]([C@@]2(CC1)C)(C)CC[C@@H]1[C@]3(C)CC[C@@H](C1(C)C)C)(C)C)N1CCN(CC1)Cc1ccccc1
STL538098
Synonyms: 4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NC1CC(C)(C)NC(C1)(C)C
STL538099
Synonyms: 4-butyl-7-({1-[1-(4-chlorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-1-oxopropan-2-yl}oxy)-2H-chromen-2-one
Smiles: CCCCc1cc(=O)oc2c1ccc(c2)OC(C(=O)N1CCC2(C(C1c1ccc(cc1)Cl)CCCC2)O)C
STL538100
Synonyms: N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]norvaline
Smiles: CCCC(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C
STL538101
Synonyms: N-(furan-2-ylmethyl)-2-({[(3Z,8xi,9xi,14xi,17alpha)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetamide
Smiles: O=C(NCc1ccco1)CO/N=C\1/CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CC[C@H]2O)C)C
STL538102
Synonyms: (12aS)-6-(3,4-dimethoxyphenyl)-2-(2-hydroxyethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: OCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(c(c2)OC)OC)[nH]c2c1cccc2
STL538103
Synonyms: 1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-3-yl(4-methoxybenzyl)carbamate
Smiles: COc1ccc(cc1)CNC(=O)OC1CCN2C1=Nc1ccccc1C2
STL538104
Synonyms: (6S,6aR,13R,13aS)-N-cyclohexyl-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carboxamide
Smiles: O=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)NC1CCCCC1
STL538105
Synonyms: 1-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-N-(2-ethylhexyl)-5-oxo-L-prolinamide
Smiles: CCCCC(CNC(=O)[C@@H]1CCC(=O)N1C1OC(=O)c2c1ccc(c2OC)OC)CC
STL538106
Synonyms: (12aS)-2-[3-(1H-imidazol-1-yl)propyl]-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCn1ccnc1
STL538107
Synonyms: (12aS)-2-[2-(4-chlorophenyl)ethyl]-6-(3-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Clc1ccc(cc1)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)C)[nH]c2c1cccc2
STL538108
Synonyms: (12aS)-2-(2-chlorobenzyl)-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1Cl
STL538109
Synonyms: N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-D-valine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C)N[C@@H](C(=O)O)C(C)C
STL538110
Synonyms: N-(4-hydroxy-1,1-dioxidotetrahydrothiophen-3-yl)-2-{[4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl]oxy}acetamide
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc(c2)OCC(=O)NC1CS(=O)(=O)CC1O
STL538111
Synonyms: methylN-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-L-valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)Cn1cnc2c(c1=O)cc(c(c2)OC)OC
STL538112
Synonyms: (12aS)-2-[2-(3,4-dimethoxyphenyl)ethyl]-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccc(c(c1)OC)OC
STL538113
Synonyms: (12aS)-2-(2-chlorobenzyl)-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1Cl
STL538114
Synonyms: (8xi,9xi,14xi)-17-hydroxy-3,11,20-trioxopregna-1,4-dien-21-yl4-[(2,5-dioxopyrrolidin-1-yl)oxy]-4-oxobutanoate
Smiles: O=C(OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(=O)C1C2CCC2=CC(=O)C=C[C@]12C)CCC(=O)ON1C(=O)CCC1=O
STL538115
Synonyms: 7-[(3-bromobenzyl)oxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4-methyl-2H-chromen-2-one
Smiles: Brc1cccc(c1)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCC2(C(C1)CCCC2)O
STL538116
Synonyms: bis(2-methylpropyl)4-hydroxy-2-(4-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Smiles: COc1ccc(cc1)C1C(C(=O)OCC(C)C)C(=O)CC(C1C(=O)OCC(C)C)(C)O
STL538117
Synonyms: 3-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-8-methoxy-4-methyl-6H-benzo[c]chromen-6-one
Smiles: COc1ccc2c(c1)c(=O)oc1c2ccc(c1C)OCC(=O)N1CCC2(C(C1)CCCC2)O
STL538118
Synonyms: (12aS)-2-benzyl-6-(3-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Cc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1
STL538119
Synonyms: N-(2-chlorobenzyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1ccccc1Cl
STL538120
Synonyms: (12bR)-12b-methyl-2-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(/C=N/N2CC(=O)N3[C@](C2=O)(C)c2[nH]c4c(c2CC3)cccc4)cc(c1OC)OC
STL538121
Synonyms: (12aS)-2-(3,4-dimethoxybenzyl)-6-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(ccc1OC)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2C)[nH]c2c1cccc2
STL538122
Synonyms: (6S,6aR,13aS)-N-(2-chlorophenyl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: S=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Nc1ccccc1Cl
STL538123
Synonyms: 3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(2-phenylethyl)benzamide
Smiles: O=C(c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCCc1ccccc1
STL538124
Synonyms: (12aS)-2-(3-methoxybenzyl)-6-(naphthalen-1-yl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cccc(c1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc3c2cccc3)[nH]c2c1cccc2
STL538125
Synonyms: N-[(1-{N-[(4-methylphenyl)sulfonyl]-L-valyl}piperidin-4-yl)carbonyl]-L-asparticacid
Smiles: OC(=O)C[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@H](C(C)C)NS(=O)(=O)c1ccc(cc1)C
STL538126
Synonyms: (12bS)-2-[2-(cyclohex-1-en-1-yl)ethyl]-9-methoxy-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)CCC1=CCCCC1
STL538127
Synonyms: 7-[(3-bromobenzyl)oxy]-3-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4,8-dimethyl-2H-chromen-2-one
Smiles: Brc1cccc(c1)COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)N1CCC2(C(C1)CCCC2)O
STL538128
Synonyms: 6-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,5-dimethyl-3-phenyl-7H-furo[3,2-g]chromen-7-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C
STL538129
Synonyms: (12bR)-2-{[(E)-(3-fluorophenyl)methylidene]amino}-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Fc1cccc(c1)/C=N/N1CC(=O)N2[C@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL538130
Synonyms: phenyl{[3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}aceticacid
Smiles: O=C(NC(c1ccccc1)C(=O)O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C
STL538131
Synonyms: 4-({[({[(3E,8xi,9xi,14xi,17beta)-17-hydroxy-17-methylandrosta-1,4-dien-3-ylidene]amino}oxy)acetyl]amino}methyl)benzoicacid
Smiles: O=C(NCc1ccc(cc1)C(=O)O)CO/N=C/1\C=C[C@]2(C(=C1)CCC1C2CC[C@]2(C1CC[C@]2(C)O)C)C
STL538132
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-[4-(8-methoxy-2-oxo-2H-chromen-3-yl)phenoxy]acetamide
Smiles: COc1cccc2c1oc(=O)c(c2)c1ccc(cc1)OCC(=O)NC1CCOC(C1)(C)C
STL538133
Synonyms: 2,2-dimethyl-3-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-ylcarbonyl)cyclopropanecarboxylicacid
Smiles: OC(=O)C1C(C1(C)C)C(=O)N1CCc2c(C1)c1ccccc1[nH]2
STL538134
Synonyms: N-heptyl-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCCCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL538135
Synonyms: (12aS)-2-{[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]amino}-6-phenyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1cc(/C=N/N2CC(=O)N3[C@H](C2=O)Cc2c(C3c3ccccc3)[nH]c3c2cccc3)ccc1O
STL538136
Synonyms: 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl2-[(tert-butoxycarbonyl)amino]butanoate
Smiles: CCCCc1cc(=O)oc2c1ccc(c2C)OC(=O)C(NC(=O)OC(C)(C)C)CC
STL538137
Synonyms: 3-(1H-indol-3-yl)-1-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)propan-1-one
Smiles: O=C(N1CC2(CC1CC(C2)(C)C)C)CCc1c[nH]c2c1cccc2
STL538138
Synonyms: (12aS)-6-(3-methoxyphenyl)-2-(3-methoxypropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)OC)[nH]c2c1cccc2
STL538139
Synonyms: tert-butyl{(2S)-1-[4-({(2S)-1-[(4-ethylphenyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl}carbamate
Smiles: CCc1ccc(cc1)NC(=O)[C@H](C(C)C)NC(=O)C1CCN(CC1)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C
STL538140
Synonyms: 2-{[(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]amino}butanoicacid
Smiles: CCC(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)OC
STL538141
Synonyms: 2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(2-phenylethyl)benzamide
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1ccccc1C(=O)NCCc1ccccc1
STL538142
Synonyms: 3,4-dimethyl-2-oxo-2H-chromen-7-ylN-(tert-butoxycarbonyl)-D-alaninate
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)C)C
STL538143
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(4-acetylphenyl)-6,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: O=C1N(c2ccc(cc2)C(=O)C)C(=O)[C@H]2[C@@H]1[C@]1(C(=O)Nc3c1ccc(c3C)C)N1[C@H]2CCC1
STL538144
Synonyms: N-(furan-2-ylmethyl)-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1ccco1
STL538145
Synonyms: (1'R,2'R)-2'-(3-methoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1cccc(c1)OC)C(=O)c1c(C2=O)cccc1
STL538146
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-(thiophen-2-ylmethyl)benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1cccs1
STL538147
Synonyms: N-[3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-L-alanine
Smiles: O=C(N[C@H](C(=O)O)C)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C
STL538148
Synonyms: (11bS)-2-(3-acetylphenyl)-8-methoxy-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)c1cccc(c1)C(=O)C
STL538149
Synonyms: 7-[(2,4-dichlorobenzyl)oxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4,8-dimethyl-2H-chromen-2-one
Smiles: Clc1ccc(c(c1)Cl)COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)N1CCC2(C(C1)CCCC2)O
STL538150
Synonyms: 6,6-dimethyl-2-{[(E)-phenylmethylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1N(/N=C/c2ccccc2)CC(=O)N2C1Cc1c3ccccc3[nH]c1C2(C)C
STL538151
Synonyms: 5-{1-[bis(2-chlorophenyl)methyl]-1H-tetrazol-5-yl}-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline
Smiles: COc1c2c(CCN(C2c2nnnn2C(c2ccccc2Cl)c2ccccc2Cl)C)cc2c1OCO2
STL538152
Synonyms: 2-{2-[2,2-dimethyl-4-(3-methylbutyl)tetrahydro-2H-pyran-4-yl]ethyl}-1H-isoindole-1,3(2H)-dione
Smiles: CC(CCC1(CCOC(C1)(C)C)CCN1C(=O)c2c(C1=O)cccc2)C
STL538153
Synonyms: (3aR,6S,7aS)-2-[2-(1H-indol-3-yl)ethyl]-1-oxo-N-phenyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: O=C(C1[C@H]2C=C[C@]3([C@H]1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2)Nc1ccccc1
STL538154
Synonyms: N-[3-(dibutylamino)propyl]-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCN(CCCC)CCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL538155
Synonyms: 5''-chloro-2'-(phenylcarbonyl)-5',6',7',7a'-tetrahydrodispiro[indole-3,1'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Clc1ccc2c(c1)C1(C(=O)N2)N2CCCC2C2(C1C(=O)c1ccccc1)C(=O)Nc1c2cccc1
STL538156
Synonyms: N-[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-L-alanyl-L-tryptophan
Smiles: O=C(N[C@H](C(=O)N[C@@H](C(=O)O)Cc1c[nH]c2c1cccc2)C)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
STL538157
Synonyms: (11bS)-2-(2-ethoxyphenyl)-8-methoxy-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: CCOc1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL538158
Synonyms: (12aS)-6-(2-methoxyphenyl)-2-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccccc1
STL538159
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-[3-(morpholin-4-yl)propyl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCCCN1CCOCC1
STL538160
Synonyms: N-(4-hydroxy-1,1-dioxidotetrahydrothiophen-3-yl)-3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NC1CS(=O)(=O)CC1O
STL538161
Synonyms: (12aS)-2-(furan-2-ylmethyl)-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccco1
STL538162
Synonyms: methyl2-({[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)N2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)sc2c1CCCCCC2
STL538163
Synonyms: (12aS)-6-(2,4-dimethoxyphenyl)-2-(3-methoxypropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2OC)OC)[nH]c2c1cccc2
STL538164
Synonyms: (12aS)-6-(4-ethoxy-3-methoxyphenyl)-2-(2-methoxybenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccc(cc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1OC
STL538165
Synonyms: N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCCC1=CCCCC1
STL538166
Synonyms: (11aS)-2-(3-methylphenyl)-5-(4-methylphenyl)-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: Cc1ccc(cc1)C1N2C(=O)N(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)c1cccc(c1)C
STL538167
Synonyms: 2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]-N-propylbenzamide
Smiles: CCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL538168
Synonyms: (11aS)-2-(2-ethylphenyl)-5-(3-methylphenyl)-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: CCc1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1cccc(c1)C)c1c(C2)c2ccccc2[nH]1
STL538169
Synonyms: (11bS)-11b-methyl-2-[4-(propan-2-yl)phenyl]-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: CC(c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C
STL538170
Synonyms: methyl(1'R,2'R)-1,3-dioxo-2'-(3,4,5-trimethoxyphenyl)-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate
Smiles: COC(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1cc(OC)c(c(c1)OC)OC)C(=O)c1c(C2=O)cccc1
STL538171
Synonyms: (1'R,2'R)-1'-acetyl-2'-(3-methoxyphenyl)-8'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cc(C)cc1
STL538172
Synonyms: 5-hydroxy-N-{2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]propanoyl}tryptophan
Smiles: O=C(C(Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C)NC(C(=O)O)Cc1c[nH]c2c1cc(O)cc2
STL538173
Synonyms: tert-butyl{(2S)-4-methyl-1-[4-({(2S)-3-methyl-1-[(4-methylbenzyl)amino]-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-1-oxopentan-2-yl}carbamate
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)C)C(C)C)NC(=O)OC(C)(C)C)C
STL538174
Synonyms: (12aS)-6-(3-methylphenyl)-2-propyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)C)[nH]c2c1cccc2
STL538175
Synonyms: (12aS)-2-(4-methoxybenzyl)-6-(3-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)OC)[nH]c2c1cccc2
STL538176
Synonyms: (11bS)-8-methoxy-11b-methyl-2-octyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: CCCCCCCCN1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL538177
Synonyms: (12aS)-6-(3-chlorophenyl)-2-(4-fluorobenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Fc1ccc(cc1)CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)Cl)[nH]c2c1cccc2
STL538178
Synonyms: N~5~-carbamoyl-N~2~-[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-D-ornithine
Smiles: Cc1c(CCC(=O)N[C@@H](C(=O)O)CCCNC(=O)N)c(=O)oc2c1cc1c(C)c(oc1c2)C
STL538179
Synonyms: 3-(6-chloro-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4-hydroxy-2H-chromen-2-one
Smiles: Clc1ccc2c(c1)c1CCNC(c1[nH]2)c1c(=O)oc2c(c1O)cccc2
STL538180
Synonyms: methyl2-{[(6S,6aR,13R,13aS)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-ylcarbonothioyl]amino}benzoate
Smiles: COC(=O)c1ccccc1NC(=S)N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31
STL538181
Synonyms: N-(4-methylbenzyl)-3-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: Cc1ccc(cc1)CNC(=O)c1cccc(c1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL538182
Synonyms: (12bS)-2-(3,4-dichlorobenzyl)-9-methoxy-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)Cc1ccc(c(c1)Cl)Cl
STL538183
Synonyms: (12bS)-9-methoxy-12b-methyl-2-[3-(trifluoromethyl)benzyl]-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)Cc1cccc(c1)C(F)(F)F
STL538184
Synonyms: N~2~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-1,3-thiazol-2-yl-L-alaninamide
Smiles: COc1cc2c(cc1OC)ncn(c2=O)CC(=O)N[C@H](C(=O)Nc1nccs1)C
STL538185
Synonyms: (1'R,2'R)-1'-acetyl-2'-(3-methoxyphenyl)-1,3-dioxo-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinolin]-9'-ylacetate
Smiles: COc1cccc(c1)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2c(ccc1)OC(=O)C
STL538186
Synonyms: 1-[3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]piperidine-2-carboxylicacid
Smiles: OC(=O)C1CCCCN1C(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C
STL538187
Synonyms: (11bS)-11b-methyl-2-(naphthalen-1-yl)-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: O=C1N(c2cccc3c2cccc3)C(=O)[C@]2(N1CCc1c2[nH]c2c1cccc2)C
STL538188
Synonyms: N-(heptan-2-yl)-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCCC(NC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC)C
STL538189
Synonyms: 6,6-dimethyl-2-{[(E)-(3-methylphenyl)methylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Cc1cccc(c1)/C=N/N1CC(=O)N2C(C1=O)Cc1c(C2(C)C)[nH]c2c1cccc2
STL538190
Synonyms: (11bS)-2-hexyl-8-methoxy-11b-methyl-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: CCCCCCN1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL538191
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,7-dimethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1cc(C)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCCO2
STL538192
Synonyms: 4-chloro-N-[3-(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoyl]phenylalanine
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)NC(C(=O)O)Cc1ccc(cc1)Cl
STL538193
Synonyms: 2-deoxy-2-{[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}hexopyranose
Smiles: OCC1OC(O)C(C(C1O)O)NC=C1C(=O)N(C)C(=O)N(C1=O)C
STL538194
Synonyms: (1'R,2'R)-2'-(3,4-dimethoxyphenyl)-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(c(c1)OC)OC)C(=O)c1c(C2=O)cccc1
STL538195
Synonyms: 4-[5-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1H-tetrazol-1-yl]benzohydrazide
Smiles: NNC(=O)c1ccc(cc1)n1nnnc1C1N(C)CCc2c1c(OC)c1c(c2)OCO1
STL538196
Synonyms: N-benzyl-1-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-5-oxo-L-prolinamide
Smiles: COc1c(OC)ccc2c1C(=O)OC2N1C(=O)CC[C@H]1C(=O)NCc1ccccc1
STL538197
Synonyms: N-(butan-2-yl)-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCC(NC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C
STL538198
Synonyms: N-[(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-D-methionine
Smiles: CSCC[C@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C
STL538199
Synonyms: (12aS)-2-cyclooctyl-6-phenyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(C2CCCCCCC2)C(=O)[C@H]2N1C(c1ccccc1)c1c(C2)c2c([nH]1)cccc2
STL538200
Synonyms: N-(4-butylphenyl)-4-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCc1ccc(cc1)NC(=O)c1ccc(cc1)N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL538202
Synonyms: (12bS)-9-methoxy-12b-methyl-2-pentyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)OC
STL538203
Synonyms: N-benzyl-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: O=C(c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)NCc1ccccc1
STL538204
Synonyms: N-[(6S,6aR,13R,13aS)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-ylcarbonothioyl]-2-fluorobenzamide
Smiles: S=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)NC(=O)c1ccccc1F
STL538205
Synonyms: (11aS)-5-(3-methylphenyl)-2-(naphthalen-1-yl)-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: Cc1cccc(c1)C1N2C(=O)N(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)c1cccc2c1cccc2
STL538206
Synonyms: (11aS)-5-(3-methylphenyl)-2-[4-(propan-2-yl)phenyl]-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Smiles: Cc1cccc(c1)C1N2C(=O)N(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)c1ccc(cc1)C(C)C
STL538208
Synonyms: N-butyl-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
Smiles: CCCCNC(=O)c1ccccc1N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3
STL538209
Synonyms: tert-butyl[(2S)-1-[4-({(2S)-1-[(4-methoxybenzyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)OC)C(C)C)NC(=O)OC(C)(C)C
STL538210
Synonyms: (12aS)-2-(1,3-benzodioxol-5-ylmethyl)-6-(4-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc2c(c1)OCO2
STL538211
Synonyms: 6,6-dimethyl-2-{[(E)-(5-methylfuran-2-yl)methylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1N(/N=C/c2ccc(o2)C)CC(=O)N2C1Cc1c3ccccc3[nH]c1C2(C)C
STL538212
Synonyms: (12aS)-6-(2-ethoxyphenyl)-2-(prop-2-en-1-yl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: C=CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OCC)[nH]c2c1cccc2
STL538213
Synonyms: 3-[(5-chloro-1-benzofuran-2-yl)carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: Clc1ccc2c(c1)cc(o2)C(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL538214
Synonyms: N-({1-[N-(tert-butoxycarbonyl)-L-phenylalanyl]piperidin-4-yl}carbonyl)-L-tyrosine
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)Cc1ccccc1
STL538215
Synonyms: 3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4,8-dimethyl-7-{[3-(trifluoromethyl)benzyl]oxy}-2H-chromen-2-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)ccc(c2C)OCc1cccc(c1)C(F)(F)F
STL538216
Synonyms: 4-chloro-N-[(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]phenylalanine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)NC(C(=O)O)Cc1ccc(cc1)Cl
STL538217
Synonyms: 7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-ylN-(tert-butoxycarbonyl)-D-leucinate
Smiles: CC(C[C@H](C(=O)Oc1cc(C)cc2c1c1CCCc1c(=O)o2)NC(=O)OC(C)(C)C)C
STL538218
Synonyms: (11beta)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobutanoate
Smiles: COc1cc(CCNC(=O)CCC(=O)OCC(=O)[C@@]2(O)CC[C@@H]3[C@]2(C)C[C@H](O)[C@H]2[C@H]3CCC3=CC(=O)CC[C@]23C)ccc1OC
STL538219
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-methyl-3-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}propanamide
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N(C1CCS(=O)(=O)C1)C
STL538220
Synonyms: (12aS)-6-(2-methoxyphenyl)-2-(3,4,5-trimethoxybenzyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: COc1cc(CN2CC(=O)N3[C@H](C2=O)Cc2c(C3c3ccccc3OC)[nH]c3c2cccc3)cc(c1OC)OC
STL538221
Synonyms: (12aS)-2-butyl-6-(3-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)C)[nH]c2c1cccc2
STL538222
Synonyms: 2-hydroxy-4-[4-methoxy-3-(2-methylpropoxy)phenyl]-7,7-dimethyl-4,7-dihydrofuro[3,4-b]pyridin-5(3H)-one
Smiles: COc1ccc(cc1OCC(C)C)C1CC(=NC2=C1C(=O)OC2(C)C)O
STL538223
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-[2-(1H-indol-3-yl)ethyl]cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCCc1c[nH]c2c1cccc2)C)C)O)C
STL538224
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-[3-(methylsulfanyl)phenyl]cholan-24-amide
Smiles: CSc1cccc(c1)NC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C[C@H]1[C@H]2CC[C@H]2[C@]1(C)CC[C@H](C2)O)C
STL538225
Synonyms: ethyl3-(3,4-dihydroxy-5-methoxyphenyl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1cc(O)c(c(c1)OC)O)c(=O)oc1c2cccc1
STL538226
Synonyms: (3alpha,5beta,12alpha)-N-benzyl-3,12-dihydroxycholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCc1ccccc1)C)C)C
STL538227
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-24-[4-(2-methoxyphenyl)piperazin-1-yl]cholan-24-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C[C@H]1[C@H]2[C@H](O)C[C@H]2[C@]1(C)CC[C@H](C2)O)C
STL538228
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-3-(4-hydroxy-3-methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1ccc(c(c1)OC)O
STL538229
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-24-[4-(pyridin-2-yl)piperazin-1-yl]cholan-24-one
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N1CCN(CC1)c1ccccn1)C)C)O)C
STL538230
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-[(2E)-4-(pyridin-3-yl)-1,3-thiazol-2(3H)-ylidene]cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)/N=c\1/scc([nH]1)c1cccnc1)C)C)C
STL538231
Synonyms: N-[(1S)-2-{[2-(1H-indol-3-yl)ethyl]amino}-2-oxo-1-phenylethyl]pyridine-3-carboxamide
Smiles: O=C(c1cccnc1)N[C@@H](c1ccccc1)C(=O)NCCc1c[nH]c2c1cccc2
STL538232
Synonyms: methyl2-{[(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)acetyl]amino}-5-(2-phenylethyl)-1,3-thiazole-4-carboxylate
Smiles: COC(=O)c1nc(sc1CCc1ccccc1)NC(=O)CC1NC(=O)c2c(N=C1O)cccc2
STL538233
Synonyms: ethyl3-(2,4-dihydroxy-6-methylpyridin-3-yl)-3-(3-hydroxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1c(O)cc(nc1O)C)c1cccc(c1)O
STL538234
Synonyms: ethyl3-(furan-2-yl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccco1)c(=O)oc1c2cccc1
STL538235
Synonyms: (8S,16E)-5-methoxy-8-methyl-4-(3,4,5-trimethoxyphenyl)-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1cc(OC)c(c(c1)OC)OC
STL538236
Synonyms: ethyl3-(2-hydroxy-7-methoxyquinolin-3-yl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1cc3ccc(cc3nc1O)OC)c(=O)oc1c2cccc1
STL538237
Synonyms: (16E)-5-hydroxy-4-(3-hydroxy-4-methoxyphenyl)-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1ccc(cc1O)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538238
Synonyms: ethyl3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-[3-(2-methylpropoxy)phenyl]propanoate
Smiles: CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1cccc(c1)OCC(C)C
STL538239
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-3-(2,3,4-trimethoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1ccc(c(c1OC)OC)OC
STL538240
Synonyms: methylN-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)carbonyl]-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)c1cc(=O)n(c2c1cccc2)C
STL538241
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-24-(thiomorpholin-4-yl)cholan-24-one
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N1CCSCC1)C)C)O)C
STL538242
Synonyms: N-[4-(2-methyl-2H-tetrazol-5-yl)phenyl]-3-[(1R,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]propanamide
Smiles: O=C(Nc1ccc(cc1)c1nnn(n1)C)C[CH]N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL538243
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-3,7,12-trihydroxycholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCCSc1ccc(cc1)Cl)C)C)O)C
STL538244
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-(1H-indol-5-yl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1ccc2c(c1)cc[nH]2)C)C)O)C
STL538245
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-(tetrahydro-2H-pyran-4-ylmethyl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCC1CCOCC1)C)C)C
STL538246
Synonyms: (11aS)-10-[2-oxo-2-(thiomorpholin-4-yl)ethyl]-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
Smiles: O=C1[C@@H]2CCCN2C(=O)c2c(N1CC(=O)N1CCSCC1)cccc2
STL538247
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-3-(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1cc2cc(OC)ccc2[nH]c1=O
STL538248
Synonyms: 4-{[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]carbonyl}-2-(2-methoxyethyl)isoquinolin-1(2H)-one
Smiles: COCCn1cc(C(=O)N2CC[C@@]3([C@H](C2)CCCC3)O)c2c(c1=O)cccc2
STL538249
Synonyms: (2S)-N-(1H-indol-4-yl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Smiles: O=C([C@@H](N1Cc2c(C1=O)cccc2)C)Nc1cccc2c1cc[nH]2
STL538250
Synonyms: (16E)-5-hydroxy-4-(3-hydroxyphenyl)-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: O=C1CCC/C=C/c2cc3OC(=O)CC(c3c(c2C(=O)OC(CCC1)C)O)c1cccc(c1)O
STL538251
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-(pyridin-3-ylmethyl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCc1cccnc1)C)C)O)C
STL538252
Synonyms: 2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]-N-(furan-2-ylmethyl)acetamide
Smiles: O=C(CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)NCc1ccco1
STL538253
Synonyms: (8S,16E)-5-methoxy-4-(2-methoxyphenyl)-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1ccccc1OC
STL538254
Synonyms: (16E)-5-hydroxy-4-(4-methoxynaphthalen-1-yl)-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1ccc(c2c1cccc2)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538255
Synonyms: 3-methyl-4-(2-methylpropyl)-1-(9H-purin-6-yl)-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: CC(CC1CC(=Nc2c1c(C)nn2c1ncnc2c1nc[nH]2)O)C
STL538256
Synonyms: ethyl(2Z)-4-methyl-2-{[(3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-24-oxocholan-24-yl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1s/c(=N\C(=O)CC[C@H]([C@H]2CC[C@@H]3[C@]2(C)[C@@H](O)C[C@H]2[C@H]3[C@H](O)C[C@H]3[C@]2(C)CC[C@H](C3)O)C)/[nH]c1C
STL538257
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-(3,4,5-trimethoxyphenyl)cholan-24-amide
Smiles: COc1cc(NC(=O)CC[C@H]([C@H]2CC[C@@H]3[C@]2(C)[C@@H](O)C[C@H]2[C@H]3CC[C@H]3[C@]2(C)CC[C@H](C3)O)C)cc(c1OC)OC
STL538258
Synonyms: methyl4-[(16E)-5-hydroxy-8-methyl-2,6,12-trioxo-3,4,8,9,10,11,12,13,14,15-decahydro-2H,6H-oxacyclotetradecino[3,4-g]chromen-4-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538259
Synonyms: ethyl3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-[4-(octyloxy)phenyl]propanoate
Smiles: CCCCCCCCOc1ccc(cc1)C(c1oc(CO)cc(=O)c1O)CC(=O)OCC
STL538260
Synonyms: (16E)-5-hydroxy-4-[4-methoxy-3-(2-methylpropoxy)phenyl]-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1ccc(cc1OCC(C)C)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538261
Synonyms: methyl(2E)-2-{[(3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl]imino}-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Smiles: COC(=O)c1[nH]/c(=N\C(=O)CC[C@H]([C@H]2CC[C@@H]3[C@]2(C)[C@@H](O)C[C@H]2[C@H]3CC[C@H]3[C@]2(C)CC[C@H](C3)O)C)/sc1C(C)C
STL538262
Synonyms: (3alpha,5beta,12alpha)-N-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3,12-dihydroxycholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)/N=c/1\[nH]c2c([nH]1)cccc2)C)C)C
STL538263
Synonyms: 2-[3-methyl-1-oxo-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)butan-2-yl]-2,3-dihydro-1H-isoindol-1-one
Smiles: CC(C(N1Cc2c(C1=O)cccc2)C(=O)N1CCc2c(C1)c1ccccc1[nH]2)C
STL538264
Synonyms: ethyl3-(2,4-dihydroxy-6-methylpyridin-3-yl)-3-(4-hydroxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1c(O)cc(nc1O)C)c1ccc(cc1)O
STL538265
Synonyms: 2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)CN1C(=O)C(C)N=C(c3c1cccc3)O)c[nH]2
STL538266
Synonyms: 3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-N-(1H-indol-4-yl)propanamide
Smiles: O=C(Nc1cccc2c1cc[nH]2)CCC1NC(=O)c2c(N=C1O)cccc2
STL538267
Synonyms: methylN-[(3-methyl-4-oxo-2-phenyl-4H-chromen-8-yl)carbonyl]-L-alaninate
Smiles: COC(=O)[C@@H](NC(=O)c1cccc2c1oc(c1ccccc1)c(c2=O)C)C
STL538268
Synonyms: ethyl4-oxo-3-(2,4,6-trimethoxyphenyl)-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1c(OC)cc(cc1OC)OC)c(=O)oc1c2cccc1
STL538269
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2C)O)NC1CCOC(C1)(C)C
STL538270
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-24-(thiomorpholin-4-yl)cholan-24-one
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N1CCSCC1)C)C)C
STL538271
Synonyms: ethyl4-oxo-3-[4-(propan-2-yloxy)phenyl]-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccc(cc1)OC(C)C)c(=O)oc1c2cccc1
STL538272
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-[1-(2-methoxyethyl)-1H-indol-4-yl]cholan-24-amide
Smiles: COCCn1ccc2c1cccc2NC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C[C@H]1[C@H]2CC[C@H]2[C@]1(C)CC[C@H](C2)O)C
STL538273
Synonyms: ethyl(2E)-2-{[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate
Smiles: CCOC(=O)c1cs/c(=N/C(=O)CN2C(=O)C3CCCN3C(=O)c3c2cccc3)/[nH]1
STL538274
Synonyms: 1-[(1R,4aS,8aS)-1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-3-phenylpropan-1-one
Smiles: COc1ccc(c(c1)[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)C(=O)CCc1ccccc1)OC
STL538275
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-3,7,12-trihydroxycholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)/N=c\1/sc2c([nH]1)cccc2)C)C)O)C
STL538276
Synonyms: 4-hydroxy-9-(3-hydroxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purin-2(1H)-one
Smiles: CC1CN(c2cccc(c2)O)c2n(C1)c1c(O)nc(=O)n(c1n2)C
STL538277
Synonyms: ethyl3-cyclohexyl-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate
Smiles: CCOC(=O)CC(c1oc(CO)cc(=O)c1O)C1CCCCC1
STL538278
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-24-(pyrrolidin-1-yl)cholan-24-one
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N1CCCC1)C)C)O)C
STL538279
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-[(2E)-4-(pyridin-2-yl)-1,3-thiazol-2(3H)-ylidene]cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)/N=c\1/scc([nH]1)c1ccccn1)C)C)C
STL538280
Synonyms: ethyl3-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1cc(OC)c(c(c1)OC)O)c(=O)oc1c2cccc1
STL538281
Synonyms: 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-[(2Z)-4-(pyridin-3-yl)-1,3-thiazol-2(3H)-ylidene]pentanamide
Smiles: O=C1N[C@@H]2[C@H](N1)[C@@H](SC2)CCCCC(=O)/N=c/1\scc([nH]1)c1cccnc1
STL538282
Synonyms: (16E)-5-hydroxy-4-[3-methoxy-2-(propan-2-yloxy)phenyl]-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1cccc(c1OC(C)C)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538283
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-N-(1-benzylpiperidin-4-yl)-3,7,12-trihydroxycholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NC1CCN(CC1)Cc1ccccc1)C)C)O)C
STL538284
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-5-methylhexanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)CC(C)C
STL538285
Synonyms: ethyl3-(1,3-benzodioxol-5-yl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccc3c(c1)OCO3)c(=O)oc1c2cccc1
STL538286
Synonyms: N-(1H-indol-5-yl)-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Smiles: COCCN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)Nc1ccc2c(c1)cc[nH]2
STL538287
Synonyms: 2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N-(2-methoxybenzyl)acetamide
Smiles: COc1ccccc1CNC(=O)CN1C(=O)C(C)N=C(c2c1cccc2)O
STL538288
Synonyms: N-[2-(3-fluorophenyl)ethyl]-2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)acetamide
Smiles: O=C(CN1C(=O)C(C)N=C(c2c1cccc2)O)NCCc1cccc(c1)F
STL538289
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]cholan-24-amide
Smiles: COCc1n[nH]/c(=N/C(=O)CC[C@H]([C@H]2CC[C@@H]3[C@]2(C)[C@@H](O)C[C@H]2[C@H]3CC[C@H]3[C@]2(C)CC[C@H](C3)O)C)/s1
STL538290
Synonyms: (3alpha,5beta,12alpha)-N-[5-(acetylamino)-2-methoxyphenyl]-3,12-dihydroxycholan-24-amide
Smiles: COc1ccc(cc1NC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C[C@H]1[C@H]2CC[C@H]2[C@]1(C)CC[C@H](C2)O)C)NC(=O)C
STL538291
Synonyms: 2-hydroxy-3-(propan-2-yl)-3,4-dihydro-5H-1,4-benzodiazepin-5-one
Smiles: CC(C1NC(=O)c2c(N=C1O)cccc2)C
STL538292
Synonyms: 2-hydroxy-7,7-dimethyl-4-(quinolin-6-yl)-4,7-dihydrofuro[3,4-b]pyridin-5(3H)-one
Smiles: OC1=NC2=C(C(C1)c1ccc3c(c1)cccn3)C(=O)OC2(C)C
STL538293
Synonyms: 2-hydroxy-7,7-dimethyl-4-(propan-2-yl)-4,7-dihydrofuro[3,4-b]pyridin-5(3H)-one
Smiles: CC(C1CC(=NC2=C1C(=O)OC2(C)C)O)C
STL538294
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-(pyridin-4-yl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1ccncc1)C)C)C
STL538295
Synonyms: ethyl3-(3,5-dimethoxyphenyl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1cc(OC)cc(c1)OC)c(=O)oc1c2cccc1
STL538296
Synonyms: (8S,16E)-4-(3,4-dimethoxyphenyl)-5-methoxy-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1ccc(c(c1)OC)OC
STL538297
Synonyms: N-(1H-indol-6-yl)-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Smiles: COCCN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)Nc1ccc2c(c1)[nH]cc2
STL538298
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-(2-phenylethyl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCCc1ccccc1)C)C)O)C
STL538299
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-3-(3-hydroxy-4-methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1ccc(c(c1)O)OC
STL538300
Synonyms: 2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]-N-[2-(4-methoxyphenyl)ethyl]acetamide
Smiles: COc1ccc(cc1)CCNC(=O)CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2
STL538301
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-(4-phenylbutan-2-yl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NC(CCc1ccccc1)C)C)C)O)C
STL538302
Synonyms: ethyl3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1cc(OC)c3c(c1)OCCO3)c(=O)oc1c2cccc1
STL538303
Synonyms: ethyl3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccc3c(c1)OCCO3)c(=O)oc1c2cccc1
STL538304
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-(3,4,5-trimethoxyphenyl)cholan-24-amide
Smiles: COc1cc(NC(=O)CC[C@H]([C@H]2CC[C@@H]3[C@]2(C)[C@@H](O)C[C@H]2[C@H]3[C@H](O)C[C@H]3[C@]2(C)CC[C@H](C3)O)C)cc(c1OC)OC
STL538305
Synonyms: ethyl3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-(5-phenylfuran-2-yl)propanoate
Smiles: CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1ccc(o1)c1ccccc1
STL538306
Synonyms: N-{6-[(1R,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridin-3-yl}-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Smiles: O=C(c1ccc2c(c1)OCCCO2)Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL538307
Synonyms: ethyl[(2Z)-2-{[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetyl]imino}-2,3-dihydro-1,3-thiazol-4-yl]acetate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)CN2C(=O)C3CCCN3C(=O)c3c2cccc3)/[nH]1
STL538308
Synonyms: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)acetamide
Smiles: O=C(CN1C(=O)C(C)N=C(c2c1cccc2)O)Nc1sc(c(n1)C)C
STL538309
Synonyms: 3-(3-acetyl-1H-indol-1-yl)-N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)propanamide
Smiles: O=C(NC1CCOC(C1)(C)C)CCn1cc(c2c1cccc2)C(=O)C
STL538310
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-N-benzyl-3,7,12-trihydroxy-N-methylcholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N(Cc1ccccc1)C)C)C)O)C
STL538311
Synonyms: ethyl3-(1,3-benzodioxol-5-yl)-3-(2,4-dihydroxyquinolin-3-yl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1ccc2c(c1)OCO2
STL538312
Synonyms: 3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)propanamide
Smiles: O=C(Nc1c(C)nn(c1C)C)CCC1NC(=O)c2c(N=C1O)cccc2
STL538313
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-24-(morpholin-4-yl)cholan-24-one
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N1CCOCC1)C)C)C
STL538314
Synonyms: (8S,16E)-5-methoxy-8-methyl-4-phenyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1ccccc1
STL538315
Synonyms: 5-(1,2-dithiolan-3-yl)-N-[2-(1H-indol-3-yl)ethyl]pentanamide
Smiles: O=C(NCCc1c[nH]c2c1cccc2)CCCCC1SSCC1
STL538316
Synonyms: (16E)-5-hydroxy-8-methyl-4-(thiophen-3-yl)-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: O=C1CCC/C=C/c2cc3OC(=O)CC(c3c(c2C(=O)OC(CCC1)C)O)c1cscc1
STL538317
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-[(2E)-4-(pyridin-2-yl)-1,3-thiazol-2(3H)-ylidene]cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)/N=c\1/scc([nH]1)c1ccccn1)C)C)O)C
STL538318
Synonyms: (8S,16E)-5-methoxy-4-[4-methoxy-3-(propan-2-yloxy)phenyl]-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1ccc(c(c1)OC(C)C)OC
STL538319
Synonyms: 3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]carbamoyl}-2,2-dimethylcyclopropanecarboxylicacid
Smiles: COc1ccc2c(c1)c(CCNC(=O)C1C(C1(C)C)C(=O)O)c[nH]2
STL538320
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-(1H-imidazol-2-yl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1ncc[nH]1)C)C)C
STL538321
Synonyms: 2-[(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)sulfanyl]butanedioicacid
Smiles: COc1ccc2c(c1)c(SC(C(=O)O)CC(=O)O)c1c(n2)CCCC1
STL538322
Synonyms: ethyl4-oxo-3-[4-(propan-2-yl)phenyl]-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccc(cc1)C(C)C)c(=O)oc1c2cccc1
STL538323
Synonyms: (16E)-5-hydroxy-8-methyl-4-(3,4,5-trimethoxyphenyl)-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538324
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3,7,12-trihydroxycholan-24-amide
Smiles: COc1cc(CCNC(=O)CC[C@H]([C@H]2CC[C@@H]3[C@]2(C)[C@@H](O)C[C@H]2[C@H]3[C@H](O)C[C@H]3[C@]2(C)CC[C@H](C3)O)C)ccc1OC
STL538325
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-4-methylpentanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)C(C)C
STL538326
Synonyms: 3-(2-hydroxy-7,7-dimethyl-5-oxo-3,4,5,7-tetrahydrofuro[3,4-b]pyridin-4-yl)-6-methoxyquinolin-2(1H)-one
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)C1CC(=NC2=C1C(=O)OC2(C)C)O
STL538327
Synonyms: (11aS)-10-{2-[4-(methylsulfonyl)piperazin-1-yl]-2-oxoethyl}-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
Smiles: O=C(N1CCN(CC1)S(=O)(=O)C)CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2
STL538328
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-[(2Z)-1,3,4-thiadiazol-2(3H)-ylidene]cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)/N=c/1\scn[nH]1)C)C)O)C
STL538329
Synonyms: (8S,16E)-5-methoxy-8-methyl-4-[4-(propan-2-yloxy)phenyl]-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1ccc(cc1)OC(C)C
STL538330
Synonyms: 2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N-(1H-indol-6-yl)acetamide
Smiles: O=C(CN1C(=O)C(C)N=C(c2c1cccc2)O)Nc1ccc2c(c1)[nH]cc2
STL538331
Synonyms: (8S,16E)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methoxy-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1ccc2c(c1)OCCO2
STL538332
Synonyms: ethyl3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-(2-methyl-2H-chromen-3-yl)propanoate
Smiles: CCOC(=O)CC(c1oc(CO)cc(=O)c1O)C1=Cc2ccccc2OC1C
STL538333
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Smiles: COc1ccc(cc1)CCn1cc(C(=O)NC2CCOC(C2)(C)C)c2c(c1=O)cccc2
STL538334
Synonyms: ethyl3-(1-methyl-1H-pyrazol-4-yl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1cnn(c1)C)c(=O)oc1c2cccc1
STL538335
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-N-benzyl-3,7,12-trihydroxycholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCc1ccccc1)C)C)O)C
STL538336
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-(3,4,5-trifluorophenyl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1cc(F)c(c(c1)F)F)C)C)C
STL538337
Synonyms: 3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)propanamide
Smiles: O=C(NCc1nnc2n1cccc2)CCC1NC(=O)c2c(N=C1O)cccc2
STL538338
Synonyms: methylN-{[4-oxo-3-(propan-2-yl)-3,4-dihydrophthalazin-1-yl]acetyl}-L-alaninate
Smiles: COC(=O)[C@@H](NC(=O)Cc1nn(C(C)C)c(=O)c2c1cccc2)C
STL538339
Synonyms: (8S,16E)-5-methoxy-4-[3-methoxy-4-(propan-2-yloxy)phenyl]-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1ccc(c(c1)OC)OC(C)C
STL538340
Synonyms: 5-(1,2-dithiolan-3-yl)-N-[3-(1H-tetrazol-1-yl)phenyl]pentanamide
Smiles: O=C(Nc1cccc(c1)n1cnnn1)CCCCC1SSCC1
STL538341
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-(1-methyl-1H-indol-4-yl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1cccc2c1ccn2C)C)C)C
STL538342
Synonyms: (16E)-5-hydroxy-8-methyl-4-(naphthalen-1-yl)-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: O=C1CCC/C=C/c2cc3OC(=O)CC(c3c(c2C(=O)OC(CCC1)C)O)c1cccc2c1cccc2
STL538343
Synonyms: 3-(butan-2-yl)-2-hydroxy-3,4-dihydro-5H-1,4-benzodiazepin-5-one
Smiles: CCC(C1NC(=O)c2c(N=C1O)cccc2)C
STL538344
Synonyms: ethyl3-(3-hydroxyphenyl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1cccc(c1)O)c(=O)oc1c2cccc1
STL538345
Synonyms: 2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N-[2-(phenylsulfanyl)ethyl]acetamide
Smiles: O=C(CN1C(=O)C(C)N=C(c2c1cccc2)O)NCCSc1ccccc1
STL538346
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-3-(furan-2-yl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1ccco1
STL538347
Synonyms: (2R,3S,4S,4aR,10bS)-3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-7-(thiomorpholin-4-ylmethyl)-3,4,4a,10b-tetrahydropyrano[3,2-c]isochromen-6(2H)-one
Smiles: OC[C@H]1O[C@@H]2[C@@H]([C@H]([C@@H]1O)O)OC(=O)c1c2c(O)c(c(c1CN1CCSCC1)O)OC
STL538348
Synonyms: 2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]-N-(3,4,5-trifluorophenyl)acetamide
Smiles: O=C(CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)Nc1cc(F)c(c(c1)F)F
STL538349
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-3-(2,3-dimethoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1cccc(c1OC)OC
STL538350
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-[1-(propan-2-yl)-1H-indol-4-yl]cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1cccc2c1ccn2C(C)C)C)C)C
STL538351
Synonyms: (3alpha,5beta,12alpha)-N-(1,3-benzodioxol-5-ylmethyl)-3,12-dihydroxycholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCc1ccc2c(c1)OCO2)C)C)C
STL538352
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-24-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3,7,12-trihydroxycholan-24-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C[C@H]1[C@H]2[C@H](O)C[C@H]2[C@]1(C)CC[C@H](C2)O)C
STL538353
Synonyms: N-[2-(4-tert-butyl-1,3-thiazol-2-yl)ethyl]-2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetamide
Smiles: O=C(CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)NCCc1scc(n1)C(C)(C)C
STL538354
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-(3-methylbutyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Smiles: CC(CCn1cc(C(=O)NC2CCOC(C2)(C)C)c2c(c1=O)cccc2)C
STL538355
Synonyms: N-cyclooctyl-2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetamide
Smiles: O=C(CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)NC1CCCCCCC1
STL538356
Synonyms: (16E)-4-(2,4-dimethoxyphenyl)-5-hydroxy-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1ccc(c(c1)OC)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538357
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-24-(3,4-dihydroisoquinolin-2(1H)-yl)-3,7,12-trihydroxycholan-24-one
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N1CCc2c(C1)cccc2)C)C)O)C
STL538358
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-(1,3-dioxo-2-azaspiro[4.4]non-2-yl)acetamide
Smiles: O=C(CN1C(=O)CC2(C1=O)CCCC2)NC1CCOC(C1)(C)C
STL538359
Synonyms: (16E)-5-hydroxy-8-methyl-4-[4-(methylsulfanyl)phenyl]-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: CSc1ccc(cc1)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538360
Synonyms: ethyl3-(7-chloro-1,3-benzodioxol-5-yl)-3-(2,4-dihydroxyquinolin-3-yl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1cc(Cl)c2c(c1)OCO2
STL538361
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-3-[4-(methylsulfanyl)phenyl]propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1ccc(cc1)SC
STL538362
Synonyms: N-[5-(acetylamino)-2-methoxyphenyl]-3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)propanamide
Smiles: COc1ccc(cc1NC(=O)CCC1NC(=O)c2c(N=C1O)cccc2)NC(=O)C
STL538363
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)propanamide
Smiles: O=C(NC1CCOC(C1)(C)C)CCC1NC(=O)c2c(N=C1O)cccc2
STL538364
Synonyms: 4-(heptan-3-yl)-3-methyl-1-(9H-purin-6-yl)-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: CCCCC(C1CC(=Nc2c1c(C)nn2c1ncnc2c1nc[nH]2)O)CC
STL538365
Synonyms: 2'-benzyl-1'-oxo-N-(tetrahydrofuran-2-ylmethyl)-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Smiles: O=C(C1c2ccccc2C(=O)N(C21CCCC2)Cc1ccccc1)NCC1CCCO1
STL538366
Synonyms: 2-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-N-[5-(propan-2-yl)-1H-1,2,4-triazol-3-yl]acetamide
Smiles: O=C(CC1NC(=O)c2c(N=C1O)cccc2)Nc1n[nH]c(n1)C(C)C
STL538367
Synonyms: 2-(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)-N-[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: COCc1n[nH]/c(=N/C(=O)CN2C(=O)C3CCCN3C(=O)c3c2cccc3)/s1
STL538368
Synonyms: methylN-[(1-methyl-1H-indol-4-yl)carbonyl]-L-leucinate
Smiles: COC(=O)[C@@H](NC(=O)c1cccc2c1ccn2C)CC(C)C
STL538369
Synonyms: methylN-[3-(3-hydroxyquinoxalin-2-yl)propanoyl]-L-valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)CCc1nc2ccccc2nc1O
STL538370
Synonyms: 2-hydroxy-4-[4-methoxy-3-(propan-2-yloxy)phenyl]-7,7-dimethyl-4,7-dihydrofuro[3,4-b]pyridin-5(3H)-one
Smiles: COc1ccc(cc1OC(C)C)C1CC(=NC2=C1C(=O)OC2(C)C)O
STL538371
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Smiles: COCCn1cc(C(=O)NC2CCOC(C2)(C)C)c2c(c1=O)cccc2
STL538372
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-(pyridin-2-ylmethyl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCc1ccccn1)C)C)C
STL538373
Synonyms: (16E)-5-hydroxy-4-{3-methoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1cc(ccc1OCC(=C)C)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538374
Synonyms: (16E)-5-hydroxy-4-(2-methoxyphenyl)-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1ccccc1C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538375
Synonyms: (3alpha,5beta,12alpha)-24-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-3,12-dihydroxycholan-24-one
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N1CCC(CC1)(O)c1ccc(cc1)Cl)C)C)C
STL538376
Synonyms: 2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]-N-(tetrahydro-2H-pyran-4-ylmethyl)acetamide
Smiles: O=C(CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)NCC1CCOCC1
STL538377
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-24-(2-phenylmorpholin-4-yl)cholan-24-one
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N1CCOC(C1)c1ccccc1)C)C)O)C
STL538378
Synonyms: ethyl3-[4-methoxy-3-(2-methoxy-2-oxoethoxy)phenyl]-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccc(c(c1)OCC(=O)OC)OC)c(=O)oc1c2cccc1
STL538379
Synonyms: (16E)-5-hydroxy-4-(4-methoxyphenyl)-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1ccc(cc1)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538380
Synonyms: 4-hydroxy-9-(4-hydroxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purin-2(1H)-one
Smiles: CC1CN(c2ccc(cc2)O)c2n(C1)c1c(O)nc(=O)n(c1n2)C
STL538381
Synonyms: ethyl3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-{3-methoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}propanoate
Smiles: CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1ccc(c(c1)OC)OCC(=C)C
STL538382
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-(pyridin-4-ylmethyl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCc1ccncc1)C)C)C
STL538383
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-(6-methylpyridin-2-yl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1cccc(n1)C)C)C)O)C
STL538384
Synonyms: 2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]-N-(3-methylbutyl)acetamide
Smiles: CC(CCNC(=O)CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)C
STL538385
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-(1H-indol-4-yl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1cccc2c1cc[nH]2)C)C)C
STL538386
Synonyms: N-(1,3-benzothiazol-2-yl)-2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)acetamide
Smiles: O=C(CN1C(=O)C(C)N=C(c2c1cccc2)O)Nc1nc2c(s1)cccc2
STL538387
Synonyms: 4-[(2-carbamoylphenyl)amino]-4-oxo-2-(pyrrolidin-1-ylmethyl)butanoicacid
Smiles: O=C(Nc1ccccc1C(=O)N)CC(C(=O)O)CN1CCCC1
STL538388
Synonyms: ethyl(2Z)-2-{[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1s/c(=N\C(=O)CN2C(=O)C3CCCN3C(=O)c3c2cccc3)/[nH]c1C
STL538389
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)acetamide
Smiles: O=C(CN1C(=O)C(C)N=C(c2c1cccc2)O)NCc1ccc2c(c1)OCO2
STL538390
Synonyms: methylN-[3-(3-hydroxyquinoxalin-2-yl)propanoyl]-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)CCc1nc2ccccc2nc1O
STL538391
Synonyms: 3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-N-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]propanamide
Smiles: O=C(Nc1n[nH]c(n1)CC(C)C)CCC1NC(=O)c2c(N=C1O)cccc2
STL538392
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-carboxamide
Smiles: COc1ccc(cc1)C1(CCOCC1)C(=O)NC1CCOC(C1)(C)C
STL538394
Synonyms: methylN-{[4-oxo-3-(propan-2-yl)-3,4-dihydrophthalazin-1-yl]acetyl}-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)Cc1nn(C(C)C)c(=O)c2c1cccc2
STL538395
Synonyms: 2-{4-[(16E)-5-hydroxy-8-methyl-2,6,12-trioxo-3,4,8,9,10,11,12,13,14,15-decahydro-2H,6H-oxacyclotetradecino[3,4-g]chromen-4-yl]-2-methoxyphenoxy}acetamide
Smiles: COc1cc(ccc1OCC(=O)N)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538396
Synonyms: N-(1H-indol-6-yl)-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Smiles: COCCN1C(=O)c2ccccc2C(C21CCCC2)C(=O)Nc1ccc2c(c1)[nH]cc2
STL538397
Synonyms: 3-(2-hydroxy-7,7-dimethyl-5-oxo-3,4,5,7-tetrahydrofuro[3,4-b]pyridin-4-yl)-7-methoxyquinolin-2(1H)-one
Smiles: COc1ccc2c(c1)[nH]c(=O)c(c2)C1CC(=NC2=C1C(=O)OC2(C)C)O
STL538398
Synonyms: ethyl3-(1-methyl-2-oxo-1,2-dihydroquinolin-3-yl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1cc3ccccc3n(c1=O)C)c(=O)oc1c2cccc1
STL538399
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-(4-methoxybenzyl)cholan-24-amide
Smiles: COc1ccc(cc1)CNC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C[C@H]1[C@H]2[C@H](O)C[C@H]2[C@]1(C)CC[C@H](C2)O)C
STL538400
Synonyms: 5-{2-[(3-carboxyphenyl)amino]-2-oxoethyl}-3-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylicacid
Smiles: COc1ccc(cc1)C1=NOC(C1)(CC(=O)Nc1cccc(c1)C(=O)O)C(=O)O
STL538401
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-3-(4-methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1ccc(cc1)OC
STL538402
Synonyms: ethyl3-[3-methoxy-4-(propan-2-yloxy)phenyl]-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccc(c(c1)OC)OC(C)C)c(=O)oc1c2cccc1
STL538403
Synonyms: 8-methoxy-N-{6-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridin-3-yl}-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Smiles: COc1cc(cc2c1OCCO2)C(=O)Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
STL538404
Synonyms: 2'-(2-methylpropyl)-1'-oxo-N-propyl-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Smiles: CCCNC(=O)C1c2ccccc2C(=O)N(C21CCCCC2)CC(C)C
STL538405
Synonyms: ethyl3-(2,4-dihydroxy-6-methylpyridin-3-yl)-3-(3-methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1c(O)cc(nc1O)C)c1cccc(c1)OC
STL538406
Synonyms: 2-hydroxy-7,7-dimethyl-4-[3-(2-methylpropoxy)phenyl]-4,7-dihydrofuro[3,4-b]pyridin-5(3H)-one
Smiles: CC(COc1cccc(c1)C1CC(=NC2=C1C(=O)OC2(C)C)O)C
STL538407
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)acetamide
Smiles: COc1cc(CCNC(=O)CN2C(=O)C(C)N=C(c3c2cccc3)O)ccc1OC
STL538408
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-(1H-indol-4-yl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1cccc2c1cc[nH]2)C)C)O)C
STL538409
Synonyms: ethyl3-(2H-chromen-3-yl)-3-(2,4-dihydroxyquinolin-3-yl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)C1=Cc2c(OC1)cccc2
STL538410
Synonyms: methyl(2E)-2-{[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetyl]imino}-5-propyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Smiles: CCCc1s/c(=N/C(=O)CN2C(=O)C3CCCN3C(=O)c3c2cccc3)/[nH]c1C(=O)OC
STL538411
Synonyms: ethyl3-(2,4-dihydroxyquinolin-3-yl)-3-(3,4,5-trimethoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1c(O)nc2c(c1O)cccc2)c1cc(OC)c(c(c1)OC)OC
STL538412
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-24-[4-(pyridin-2-yl)piperazin-1-yl]cholan-24-one
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N1CCN(CC1)c1ccccn1)C)C)C
STL538413
Synonyms: N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}propanamide
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NC1CCOC(C1)(C)C
STL538414
Synonyms: N-[6-(1,3-benzodioxol-5-yloxy)pyridin-3-yl]-2,2-dimethyltetrahydro-2H-pyran-4-carboxamide
Smiles: O=C(C1CCOC(C1)(C)C)Nc1ccc(nc1)Oc1ccc2c(c1)OCO2
STL538415
Synonyms: methyl(2E)-2-{[(3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl]imino}-5-(2-methylpropyl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Smiles: COC(=O)c1[nH]/c(=N\C(=O)CC[C@H]([C@H]2CC[C@@H]3[C@]2(C)[C@@H](O)C[C@H]2[C@H]3CC[C@H]3[C@]2(C)CC[C@H](C3)O)C)/sc1CC(C)C
STL538416
Synonyms: (3alpha,5beta,12alpha)-N-(4-carbamoylphenyl)-3,12-dihydroxycholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1ccc(cc1)C(=O)N)C)C)C
STL538417
Synonyms: ethyl3-(2,4-dihydroxy-6-methylpyridin-3-yl)-3-(2,3,4-trimethoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(c(c1OC)OC)OC)c1c(O)cc(nc1O)C
STL538418
Synonyms: 2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
Smiles: COc1ccccc1CCNC(=O)CN1C(=O)C(C)N=C(c2c1cccc2)O
STL538419
Synonyms: 5-(1,2-dithiolan-3-yl)-N-[(2E)-3,4,5,6-tetrahydro-2H-cyclopenta[d][1,3]thiazol-2-ylidene]pentanamide
Smiles: O=C(/N=c/1\[nH]c2c(s1)CCC2)CCCCC1CCSS1
STL538420
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-24-(4-benzylpiperidin-1-yl)-3,7,12-trihydroxycholan-24-one
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)N1CCC(CC1)Cc1ccccc1)C)C)O)C
STL538421
Synonyms: ethyl3-(3,4-dimethoxyphenyl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccc(c(c1)OC)OC)c(=O)oc1c2cccc1
STL538422
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-[2-(2-methoxyphenyl)ethyl]cholan-24-amide
Smiles: COc1ccccc1CCNC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C[C@H]1[C@H]2[C@H](O)C[C@H]2[C@]1(C)CC[C@H](C2)O)C
STL538423
Synonyms: methylN-[3-(3-hydroxyquinoxalin-2-yl)propanoyl]-L-phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1nc2ccccc2nc1O
STL538424
Synonyms: (8S,16E)-4-(1,3-benzodioxol-5-yl)-5-methoxy-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1ccc2c(c1)OCO2
STL538425
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-[3-(methylsulfanyl)phenyl]cholan-24-amide
Smiles: CSc1cccc(c1)NC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C[C@H]1[C@H]2[C@H](O)C[C@H]2[C@]1(C)CC[C@H](C2)O)C
STL538426
Synonyms: methyl4-{[(3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)[C@@H](O)C[C@H]1[C@H]2CC[C@H]2[C@]1(C)CC[C@H](C2)O)C
STL538427
Synonyms: (8S,16E)-5-methoxy-4-(4-methoxynaphthalen-1-yl)-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1ccc(c2c1cccc2)OC
STL538428
Synonyms: (16E)-5-hydroxy-8-methyl-4-[4-(propan-2-yl)phenyl]-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: O=C1CCC/C=C/c2cc3OC(=O)CC(c3c(c2C(=O)OC(CCC1)C)O)c1ccc(cc1)C(C)C
STL538429
Synonyms: ethyl3-(3-hydroxy-4-methoxyphenyl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccc(c(c1)O)OC)c(=O)oc1c2cccc1
STL538430
Synonyms: (16E)-5-hydroxy-4-[3-methoxy-4-(2-methylpropoxy)phenyl]-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1cc(ccc1OCC(C)C)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)C
STL538431
Synonyms: N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(5-hydroxy-3-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)acetamide
Smiles: O=C(CN1C(=O)C(C)N=C(c2c1cccc2)O)NCCC1=CCCCC1
STL538432
Synonyms: methyl(2Z)-2-{[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetyl]imino}-5-methyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Smiles: COC(=O)c1[nH]/c(=N/C(=O)CN2C(=O)C3CCCN3C(=O)c3c2cccc3)/sc1C
STL538433
Synonyms: 2-hydroxy-4-{3-methoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-7,7-dimethyl-4,7-dihydrofuro[3,4-b]pyridin-5(3H)-one
Smiles: COc1cc(ccc1OCC(=C)C)C1CC(=NC2=C1C(=O)OC2(C)C)O
STL538434
Synonyms: 2-(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C(C)C)CN1C(=O)C2CCCN2C(=O)c2c1cccc2
STL538435
Synonyms: (1'S,2'S,3R,3a'R)-1'-acetyl-7'-methoxy-2'-[(4-methylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc2c(c1)C=C[C@H]1N2[C@H](C(=O)C)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)C
STL538436
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-(4-phenoxyphenyl)cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1ccc(cc1)Oc1ccccc1)C)C)C
STL538437
Synonyms: (3alpha,5beta,7alpha,8xi,12alpha)-N-[2-(5-chloro-1H-indol-3-yl)ethyl]-3,7,12-trihydroxycholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCCc1c[nH]c2c1cc(Cl)cc2)C)C)O)C
STL538438
Synonyms: 2-{2-[(2S)-2-carbamoyl-2,3-dihydro-1H-indol-1-yl]-2-oxoethyl}benzoicacid
Smiles: NC(=O)[C@@H]1Cc2c(N1C(=O)Cc1ccccc1C(=O)O)cccc2
STL538439
Synonyms: (3alpha,5beta,12alpha)-3,12-dihydroxy-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)CC[C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)/N=c\1/[nH]nc(s1)C)C)C)C
STL538440
Synonyms: 2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]-N-(2-methylpropyl)acetamide
Smiles: CC(CNC(=O)CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)C
STL538441
Synonyms: ethyl3-(7-methoxy-1-methyl-2-oxo-1,2-dihydroquinolin-3-yl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1cc3ccc(cc3n(c1=O)C)OC)c(=O)oc1c2cccc1
STL538442
Synonyms: ethyl3-(2,4-dimethoxyphenyl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccc(cc1OC)OC)c(=O)oc1c2cccc1
STL538443
Synonyms: ethyl3-(3,4-dihydroxyphenyl)-4-oxo-2,3-dihydro-4H-furo[3,2-c]chromene-2-carboxylate
Smiles: CCOC(=O)C1Oc2c(C1c1ccc(c(c1)O)O)c(=O)oc1c2cccc1
STL538444
Synonyms: (8S,16E)-5-methoxy-4-{3-methoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-8-methyl-4,8,9,10,11,13,14,15-octahydro-2H,6H-oxacyclotetradecino[3,4-g]chromene-2,6,12(3H)-trione
Smiles: COc1c2C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/c2cc2c1C(CC(=O)O2)c1ccc(c(c1)OC)OCC(=C)C