COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552251
Chemical Name: 3-[(3S,11E)-14,16-dihydroxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-15-yl]-N-(6-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-3-(3,4,5-trimethoxyphenyl)propanamide
Smiles: COc1ccc2c(c1)c1CCCC(c1[nH]2)NC(=O)CC(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)c1cc(OC)c(c(c1)OC)OC

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Molecular Weight: 754.88
Empirical Formula: C43H50N2O10

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 7.123
Rotatable bonds: 9
H-donors: 4
H-acceptors: 10
PSA: 165
Number of rings: 6

     

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