Molecule ID: mol25791

SMILES: Nc1cnc(-c2ccccc2)nc1N

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

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization