Molecule ID: mol4024

SMILES: Cn1ccc(=S)cn1

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

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-0.83 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization