Molecule ID: mol14018

SMILES: c1coc(-c2ccncc2)c1

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

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization