COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886385
Chemical Name: 2-{[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,5-dimethoxyphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(OC)ccc2OC)NC2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C

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Molecular Weight: 538.07
Empirical Formula: C28H28ClN3O4S

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 5.119
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 125
Number of rings: 4

     

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