COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK015366
Chemical Name: (4E)-4-{2-[4-chloro-2-(phenylcarbonyl)phenyl]hydrazinylidene}-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(c(c1)C(=O)c1ccccc1)N/N=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 461.86
Empirical Formula: C23H16ClN5O4

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 4.832
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 119
Number of rings: 4

     

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