Molecule ID: mol8336

SMILES: CNc1nc(C)nc2scnc12

InChI: InChI=1S/C7H8N4S/c1-4-10-6(8-2)5-7(11-4)12-3-9-5/h3H,1-2H3,(H,8,10,11)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.66 IUPAC digitized pKa 1 » 0
3.71 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization