Molecule ID: mol13805

SMILES: c1ccc(Oc2ccncc2)cc1

InChI: InChI=1S/C11H9NO/c1-2-4-10(5-3-1)13-11-6-8-12-9-7-11/h1-9H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
6.16 OCHEM 1 » 0
6.16 QSARToolbox 1 » 0
6.16 Datawarrior 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization