pKahub
About
Molecules
Datasets
Molecule ID:
mol15840
SMILES:
O=C1CCON1
InChI:
InChI=1S/C3H5NO2/c5-3-1-2-6-4-3/h1-2H2,(H,4,5)
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
6.70
OCHEM
0 » -1
6.70
Datawarrior
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization