Molecule ID: mol7675

SMILES: Cn1cncn1

InChI: InChI=1S/C3H5N3/c1-6-3-4-2-5-6/h2-3H,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.31 OCHEM 1 » 0
2.31 QSARToolbox 1 » 0
2.31 Datawarrior 1 » 0
2.75 AttenGpKa training set 1 » 0
3.20 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization