Molecule ID: mol13804

SMILES: c1ccc(Oc2ccccn2)cc1

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

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization