Molecule ID: mol29560

SMILES: Cn1cnc2c(NC(=N)N)ncnc21

InChI: InChI=1S/C7H9N7/c1-14-3-12-4-5(13-7(8)9)10-2-11-6(4)14/h2-3H,1H3,(H4,8,9,10,11,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization