Molecule ID: mol8132

SMILES: Nc1nc(N)c2c(n1)NCCN2

InChI: InChI=1S/C6H10N6/c7-4-3-5(10-2-1-9-3)12-6(8)11-4/h9H,1-2H2,(H5,7,8,10,11,12)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
6.71 IUPAC digitized pKa 1 » 0
6.71 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization