Molecule ID: mol35985

SMILES: O=C1C=C(C(=O)O)/C(=N/Nc2ccc([N+](=O)[O-])cc2)C(=O)N1

InChI: InChI=1S/C12H8N4O6/c17-9-5-8(12(19)20)10(11(18)13-9)15-14-6-1-3-7(4-2-6)16(21)22/h1-5,14H,(H,19,20)(H,13,17,18)/b15-10-

Experimental Macro pKa Values

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