Molecule ID: mol8366

SMILES: CSc1ncc2nn[nH]c2n1

InChI: InChI=1S/C5H5N5S/c1-11-5-6-2-3-4(7-5)9-10-8-3/h2H,1H3,(H,6,7,8,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization