pKahub
About
Molecules
Datasets
Molecule ID:
mol15858
SMILES:
CCSC(C)O
InChI:
InChI=1S/C4H10OS/c1-3-6-4(2)5/h4-5H,3H2,1-2H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
14.30
QSARToolbox
0 » -1
14.34
Datawarrior
0 » -1
14.34
OCHEM
0 » -1
14.34
QSARToolbox
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization