COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK014202
Chemical Name: N-(4-bromophenyl)-2-{[3-cyano-4-(2-methylpropyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: CC(CC1C(=C(SCC(=O)Nc2ccc(cc2)Br)NC2=C1C(=O)CCC2)C#N)C

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Molecular Weight: 474.42
Empirical Formula: C22H24BrN3O2S

Physical State: Dry powder
Available Amount: 348 mg

Lipinsky:
logP: 4.429
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 107
Number of rings: 3

     

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