COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886647
Chemical Name: 2-{[4-(1,3-benzodioxol-5-yl)-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(3-chloro-2-methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2

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Molecular Weight: 508
Empirical Formula: C26H22ClN3O4S

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 4.42
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 125
Number of rings: 5

     

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