COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK754045
Chemical Name: 2-amino-4-(3,4-dimethoxyphenyl)-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(C1c1ccc(c(c1)OC)OC)C(=O)CCC2

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Molecular Weight: 446.46
Empirical Formula: C24H22N4O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.989
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 134
Number of rings: 4

     

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