COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK046719
Chemical Name: (4E)-4-[2-(3-chloro-2-methylphenyl)hydrazinylidene]-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=N/Nc1cccc(c1C)Cl)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 371.78
Empirical Formula: C17H14ClN5O3

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 3.049
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 102
Number of rings: 3

     

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