Molecule ID: mol6740

SMILES: CN(C1=NCCCO1)c1ccccc1

InChI: InChI=1S/C11H14N2O/c1-13(10-6-3-2-4-7-10)11-12-8-5-9-14-11/h2-4,6-7H,5,8-9H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization