COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826865
Chemical Name: N-tert-butyl-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)NC(C)(C)C)NC2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C

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Molecular Weight: 458.02
Empirical Formula: C24H28ClN3O2S

Physical State: Dry powder
Available Amount: 394 mg

Lipinsky:
logP: 4.099
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 107
Number of rings: 3

     

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