COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406889
Chemical Name: 2-[(E)-(3-hydroxy-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl2-nitrobenzenesulfonate
Smiles: OC1=NN(C(=O)/C/1=C/c1ccccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1

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Molecular Weight: 465.44
Empirical Formula: C22H15N3O7S

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 4.04
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 150
Number of rings: 4

     

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