Molecule ID: mol33889

SMILES: O=Nc1cc(S(=O)(=O)O)c2cccnc2c1O

InChI: InChI=1S/C9H6N2O5S/c12-9-6(11-13)4-7(17(14,15)16)5-2-1-3-10-8(5)9/h1-4,12H,(H,14,15,16)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization