pKahub
About
Molecules
Datasets
Molecule ID:
mol27816
SMILES:
C/C=[N+](\[O-])O
InChI:
InChI=1S/C2H5NO2/c1-2-3(4)5/h2H,1H3,(H,4,5)
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
4.39
AttenGpKa training set
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization