COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK959169
Chemical Name: 2-amino-4-(1,5-dimethyl-1H-pyrazol-4-yl)-1-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2cccc(c2)[N+](=O)[O-])C2=C(C1c1cnn(c1C)C)C(=O)CCC2

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Molecular Weight: 404.43
Empirical Formula: C21H20N6O3

Physical State: Dry powder
Available Amount: 49 mg

Lipinsky:
logP: 0.66
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 133
Number of rings: 4

     

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