COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK033424
Chemical Name: (4E)-4-[2-(3-acetylphenyl)hydrazinylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1N(N=C(/C/1=N\Nc1cccc(c1)C(=O)C)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 427.42
Empirical Formula: C23H17N5O4

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 3.108
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 119
Number of rings: 4

     

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