Molecule ID: mol14250

SMILES: CN(CCO)c1ccccc1

InChI: InChI=1S/C9H13NO/c1-10(7-8-11)9-5-3-2-4-6-9/h2-6,11H,7-8H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization