Molecule ID: mol25118

SMILES: c1ccc(-c2ccc(-c3ccccn3)o2)nc1

InChI: InChI=1S/C14H10N2O/c1-3-9-15-11(5-1)13-7-8-14(17-13)12-6-2-4-10-16-12/h1-10H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.20 AttenGpKa training set 2 » 1
3.41 AttenGpKa training set 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization