Molecule ID: mol13838

SMILES: OC(c1ccncc1)n1ccnc1

InChI: InChI=1S/C9H9N3O/c13-9(12-6-5-11-7-12)8-1-3-10-4-2-8/h1-7,9,13H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization