Molecule ID: mol8291

SMILES: CSc1nc(C)nc2c1ncn2C

InChI: InChI=1S/C8H10N4S/c1-5-10-7-6(8(11-5)13-3)9-4-12(7)2/h4H,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization