Molecule ID: mol4835

SMILES: CSc1cnc2cncnc2n1

InChI: InChI=1S/C7H6N4S/c1-12-6-3-9-5-2-8-4-10-7(5)11-6/h2-4H,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization