Molecule ID: mol13361

SMILES: Nc1ccnc(-c2cc(N)ccn2)c1

InChI: InChI=1S/C10H10N4/c11-7-1-3-13-9(5-7)10-6-8(12)2-4-14-10/h1-6H,(H2,11,13)(H2,12,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization