Molecule ID: mol14017

SMILES: c1cc(-c2ccoc2)ccn1

InChI: InChI=1S/C9H7NO/c1-4-10-5-2-8(1)9-3-6-11-7-9/h1-7H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization