Molecule ID: mol23443

SMILES: O=C(O)/C(S)=C/C=C/c1ccccc1

InChI: InChI=1S/C11H10O2S/c12-11(13)10(14)8-4-7-9-5-2-1-3-6-9/h1-8,14H,(H,12,13)/b7-4+,10-8-

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.96 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization