pKahub
About
Molecules
Datasets
Molecule ID:
mol28886
SMILES:
COP(C)(=O)O
InChI:
InChI=1S/C2H7O3P/c1-5-6(2,3)4/h1-2H3,(H,3,4)
Experimental Macro pKa Values
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JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
1.60
QSARToolbox
0 » -1
2.14
AttenGpKa training set
0 » -1
2.37
QSARToolbox
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization