pKahub
About
Molecules
Datasets
Molecule ID:
mol31071
SMILES:
CCOCO
InChI:
InChI=1S/C3H8O2/c1-2-5-3-4/h4H,2-3H2,1H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
13.04
AttenGpKa training set
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization