Molecule ID: mol26273

SMILES: c1ccc(-c2ncc3nccnc3n2)cc1

InChI: InChI=1S/C12H8N4/c1-2-4-9(5-3-1)11-15-8-10-12(16-11)14-7-6-13-10/h1-8H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization