COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK538634
Chemical Name: N-(3-acetylphenyl)-2-({4-[4-(benzyloxy)phenyl]-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl}sulfanyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C(=O)C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CCC2

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Molecular Weight: 563.68
Empirical Formula: C33H29N3O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.962
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 133
Number of rings: 5

     

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