COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK261639
Chemical Name: (4Z)-4-{[(4-chlorobenzyl)amino]methylidene}-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(cc1)CN/C=C\1/C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 370.79
Empirical Formula: C18H15ClN4O3

Physical State: Dry powder
Available Amount: 414 mg

Lipinsky:
logP: 3.077
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 3

     

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