COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK372390
Chemical Name: butyl2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CCC2

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Molecular Weight: 384.43
Empirical Formula: C21H24N2O5

Physical State: Dry powder
Available Amount: 194 mg

Lipinsky:
logP: 2.967
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 3

     

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