COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK088406
Chemical Name: benzyl7-(4-methoxyphenyl)-2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1cccc(c1)[N+](=O)[O-])C(=O)OCc1ccccc1)C

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Molecular Weight: 524.57
Empirical Formula: C31H28N2O6

Physical State: Dry powder
Available Amount: 188 mg

Lipinsky:
logP: 4.43
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 110
Number of rings: 5

     

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