pKahub
About
Molecules
Datasets
Molecule ID:
mol31067
SMILES:
COCO
InChI:
InChI=1S/C2H6O2/c1-4-2-3/h3H,2H2,1H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
14.01
AttenGpKa training set
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization