Molecule ID: mol37970

SMILES: O=C1C=Cc2cc(S(=O)(=O)O)ccc2/C1=N/Nc1ccc([N+](=O)[O-])cc1

InChI: InChI=1S/C16H11N3O6S/c20-15-8-1-10-9-13(26(23,24)25)6-7-14(10)16(15)18-17-11-2-4-12(5-3-11)19(21)22/h1-9,17H,(H,23,24,25)/b18-16-

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.70 QSARToolbox -1 » -2
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Charge States and Microspecies Visualization