Molecule ID: mol28238

SMILES: Fc1c(F)c(F)c(S)c(F)c1F

InChI: InChI=1S/C6HF5S/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization