Molecule ID: mol15798

SMILES: C1CN2C(=N1)N1CCN=C1N1CCN=C21

InChI: InChI=1S/C9H12N6/c1-4-13-7(10-1)14-5-2-12-9(14)15-6-3-11-8(13)15/h1-6H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
5.80 Datawarrior 3 » 2
5.80 OCHEM 3 » 2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization