Molecule ID: mol37933

SMILES: O=C(O)c1cc(N=Nc2ccc(S(=O)(=O)O)c([N+](=O)[O-])c2)ccc1O

InChI: InChI=1S/C13H9N3O8S/c17-11-3-1-7(5-9(11)13(18)19)14-15-8-2-4-12(25(22,23)24)10(6-8)16(20)21/h1-6,17H,(H,18,19)(H,22,23,24)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.15 QSARToolbox -2 » -3
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Charge States and Microspecies Visualization