COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826863
Chemical Name: N-[4-chloro-2-(phenylcarbonyl)phenyl]-2-{[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C(=O)c2ccccc2)Cl)NC2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C

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Molecular Weight: 616.57
Empirical Formula: C33H27Cl2N3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 8.253
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 124
Number of rings: 5

     

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