COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK093992
Chemical Name: 4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(cc1/C=N/c1c(=O)n(n(c1C)C)c1ccccc1)[N+](=O)[O-]

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Molecular Weight: 370.79
Empirical Formula: C18H15ClN4O3

Physical State: Dry powder
Available Amount: 163 mg

Lipinsky:
logP: 2.948
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 81
Number of rings: 3

     

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