Molecule ID: mol26065

SMILES: Cc1ccc2cc(O)ccc2[n+]1[O-]

InChI: InChI=1S/C10H9NO2/c1-7-2-3-8-6-9(12)4-5-10(8)11(7)13/h2-6,12H,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
1.66 QSARToolbox 1 » 0
8.21 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization