COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406718
Chemical Name: 4-{(2Z)-2-[3-(4-nitrophenyl)-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzenesulfonate
Smiles: O=C1/C(=N\Nc2ccc(cc2)S(=O)(=O)[O-])/C(=NN1c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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Saltdata: Na+
Molecular Weight: 464.44
Empirical Formula: C21H14N5O6S

Physical State: Dry powder
Available Amount: 10469 mg

Lipinsky:
logP: 2.265
Rotatable bonds: 1
H-donors: 1
H-acceptors: 6
PSA: 168
Number of rings: 4

     

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