pKahub
About
Molecules
Datasets
Molecule ID:
mol9112
SMILES:
CCSP(C)(=O)O
InChI:
InChI=1S/C3H9O2PS/c1-3-7-6(2,4)5/h3H2,1-2H3,(H,4,5)
Experimental Macro pKa Values
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SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
2.03
IUPAC digitized pKa
0 » -1
3.20
QSARToolbox
0 » -1
3.20
QSARToolbox
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization