COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL562056
Chemical Name: 3-(1,3-benzodioxol-5-yl)-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-[2-(5-methoxy-1H-indol-3-yl)ethyl]propanamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)CC(c1c(O)cc3c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/3)c1ccc3c(c1)OCO3)c[nH]2

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Molecular Weight: 682.77
Empirical Formula: C39H42N2O9

Available Amount: 0 mg

Lipinsky:
logP: 6.1
Rotatable bonds: 10
H-donors: 4
H-acceptors: 9
PSA: 156
Number of rings: 6

     

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