Molecule ID: mol4687

SMILES: c1ccc2nncnc2c1

InChI: InChI=1S/C7H5N3/c1-2-4-7-6(3-1)8-5-9-10-7/h1-5H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-0.82 AttenGpKa training set 1 » 0
-0.82 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization