COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK862793
Chemical Name: 4-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)quinolin-8-yl]amino}-5-nitrobenzene-1,2-dicarbonitrile
Smiles: N#Cc1cc(Nc2cccc3c2nc(cc3)n2nc(cc2C)C)c(cc1C#N)[N+](=O)[O-]

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Molecular Weight: 409.41
Empirical Formula: C22H15N7O2

Physical State: Dry powder
Available Amount: 321 mg

Lipinsky:
logP: 5.825
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 136
Number of rings: 4

     

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