Molecule ID: mol25716

SMILES: C[n+]1cnccc1S

InChI: InChI=1S/C5H6N2S/c1-7-4-6-3-2-5(7)8/h2-4H,1H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization