COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016661
Chemical Name: (4E)-4-[2-(3-chloro-2-methylphenyl)hydrazinylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1/C(=N/Nc2cccc(c2C)Cl)/C(=NN1c1ccc(cc1)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 433.85
Empirical Formula: C22H16ClN5O3

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 4.802
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 102
Number of rings: 4

     

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