COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK050253
Chemical Name: (4E)-4-[(2E)-3-(2-hydroxy-5-nitrophenyl)-1-(4-methylphenyl)prop-2-en-1-ylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)/C(=C/1\C(=NN(C1=O)c1ccccc1)C)/C=C/c1cc(ccc1O)[N+](=O)[O-]

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Molecular Weight: 439.47
Empirical Formula: C26H21N3O4

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 6.006
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 4

     

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