Molecule ID: mol3740

SMILES: COc1cncc(-c2ccccc2)c1C

InChI: InChI=1S/C13H13NO/c1-10-12(8-14-9-13(10)15-2)11-6-4-3-5-7-11/h3-9H,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization