Molecule ID: mol25611

SMILES: c1ccc(-n2nnnc2-c2nnnn2-c2ccccc2)cc1

InChI: InChI=1S/C14H10N8/c1-3-7-11(8-4-1)21-13(15-17-19-21)14-16-18-20-22(14)12-9-5-2-6-10-12/h1-10H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-7.47 AttenGpKa training set 4 » 3
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization