Molecule ID: mol13676

SMILES: Cn1ncnc1/N=N/O

InChI: InChI=1S/C3H5N5O/c1-8-3(6-7-9)4-2-5-8/h2H,1H3,(H,4,5,6,9)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
4.45 OCHEM 1 » 0
4.45 QSARToolbox 1 » 0
4.45 Datawarrior 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization