COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK014507
Chemical Name: propan-2-yl7-(3,4-dimethoxyphenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1cc(ccc1OC)C1CC2=C(C(=O)C1)C(C(=C(N2)C)C(=O)OC(C)C)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 506.56
Empirical Formula: C28H30N2O7

Physical State: Dry powder
Available Amount: 206 mg

Lipinsky:
logP: 3.654
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 119
Number of rings: 4

     

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