COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK071801
Chemical Name: (4E)-4-[2-(2,6-dichloro-4-nitrophenyl)hydrazinylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1/C(=N/Nc2c(Cl)cc(cc2Cl)[N+](=O)[O-])/C(=NN1c1ccc(cc1)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 499.27
Empirical Formula: C21H12Cl2N6O5

Physical State: Dry powder
Available Amount: 173 mg

Lipinsky:
logP: 4.987
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 148
Number of rings: 4

     

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