COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL543485
Chemical Name: N-[(7S)-10-{[(2S)-1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-methyl-1-oxobutan-2-yl]amino}-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)N[C@H](C(=O)N2CCC3(C(C2)CCCC3)O)C(C)C)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 621.77
Empirical Formula: C35H47N3O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.856
Rotatable bonds: 6
H-donors: 3
H-acceptors: 7
PSA: 126
Number of rings: 5

     

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