COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK669551
Chemical Name: 2-{[3-cyano-4-(4-methylphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(3-nitrophenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)[N+](=O)[O-])nc2c(c1c1ccc(cc1)C)CCCC2

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Saltdata: (CH3)2NCHO(10:7)
Molecular Weight: 458.54
Empirical Formula: C25H22N4O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.472
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 136
Number of rings: 4

     

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