Molecule ID: mol14089

SMILES: Fc1cc(F)c(F)c(S)c1F

InChI: InChI=1S/C6H2F4S/c7-2-1-3(8)5(10)6(11)4(2)9/h1,11H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization