Molecule ID: mol13919

SMILES: COCCNc1ccc(OC)cc1

InChI: InChI=1S/C10H15NO2/c1-12-8-7-11-9-3-5-10(13-2)6-4-9/h3-6,11H,7-8H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization