Molecule ID: mol28201

SMILES: Fc1ccc(S)c(F)c1

InChI: InChI=1S/C6H4F2S/c7-4-1-2-6(9)5(8)3-4/h1-3,9H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization