Molecule ID: mol15766

SMILES: Oc1ccccc1CNC1CCCCC1

InChI: InChI=1S/C13H19NO/c15-13-9-5-4-6-11(13)10-14-12-7-2-1-3-8-12/h4-6,9,12,14-15H,1-3,7-8,10H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.67 Datawarrior 1 » 0
8.67 AttenGpKa training set 1 » 0
8.67 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization