Molecule ID: mol32284

SMILES: O=C1C(=NO)C=Cc2ccccc21

InChI: InChI=1S/C10H7NO2/c12-10-8-4-2-1-3-7(8)5-6-9(10)11-13/h1-6,13H

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.38 QSARToolbox 0 » -1
7.52 OCHEM 0 » -1
7.67 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization