COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL258908
Chemical Name: 4-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CN1CCN(CC1)/N=C/c1c([nH]n(c1=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 406.44
Empirical Formula: C21H22N6O3

Available Amount: 0 mg

Lipinsky:
logP: 2.017
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 97
Number of rings: 4

     

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