Molecule ID: mol38000

SMILES: Cc1sc2cc(O)ccc2[n+]1C

InChI: InChI=1S/C9H9NOS/c1-6-10(2)8-4-3-7(11)5-9(8)12-6/h3-5H,1-2H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization