pKahub
About
Molecules
Datasets
Molecule ID:
mol22191
SMILES:
C=C(O)C(=O)O
InChI:
InChI=1S/C3H4O3/c1-2(4)3(5)6/h4H,1H2,(H,5,6)
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
3.91
AttenGpKa training set
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization