COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169425
Chemical Name: 4-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}-2-(4-nitrophenyl)-5-propyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CCCc1[nH]n(c(=O)c1/C=N/N1CCN(CC1)C)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 372.43
Empirical Formula: C18H24N6O3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.219
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 97
Number of rings: 3

     

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