Molecule ID: mol34497

SMILES: COc1ccc(-c2noc(O)c2N=Nc2ccc(S(=O)(=O)O)cc2)cc1

InChI: InChI=1S/C16H13N3O6S/c1-24-12-6-2-10(3-7-12)14-15(16(20)25-19-14)18-17-11-4-8-13(9-5-11)26(21,22)23/h2-9,20H,1H3,(H,21,22,23)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.16 QSARToolbox -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization