COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673894
Chemical Name: 4-{(E)-[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}phenyl3,5-dinitrobenzoate
Smiles: O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])Oc1ccc(cc1)/C=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 496.35
Empirical Formula: C20H12N6O10

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.226
Rotatable bonds: 2
H-donors: 1
H-acceptors: 10
PSA: 233
Number of rings: 3

     

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