Molecule ID: mol7412

SMILES: CSc1ccnc(N(C)C)n1

InChI: InChI=1S/C7H11N3S/c1-10(2)7-8-5-4-6(9-7)11-3/h4-5H,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization