COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK043810
Chemical Name: (4E)-5-methyl-4-[(2E)-1-(4-methylphenyl)-3-(4-nitrophenyl)prop-2-en-1-ylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)/C(=C/1\C(=NN(C1=O)c1ccccc1)C)/C=C/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 423.47
Empirical Formula: C26H21N3O3

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 5.509
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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