COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK696022
Chemical Name: N-[(1Z)-3-[(2E)-2-(2-hydroxy-3,5-dinitrobenzylidene)hydrazinyl]-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Smiles: O=C(/C(=C/c1ccc(cc1)[N+](=O)[O-])/NC(=O)c1ccccc1)N/N=C/c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 520.42
Empirical Formula: C23H16N6O9

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.575
Rotatable bonds: 3
H-donors: 3
H-acceptors: 9
PSA: 228
Number of rings: 3

     

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