COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK253336
Chemical Name: 2-(3-nitrophenyl)-2-oxoethyl2-(3,4-dimethylphenyl)quinoline-4-carboxylate
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])COC(=O)c1cc(nc2c1cccc2)c1ccc(c(c1)C)C

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Molecular Weight: 440.46
Empirical Formula: C26H20N2O5

Physical State: Dry powder
Available Amount: 874 mg

Lipinsky:
logP: 6.332
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 102
Number of rings: 4

     

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