pKahub
About
Molecules
Datasets
Molecule ID:
mol15998
SMILES:
CC(=NO)C(=O)O
InChI:
InChI=1S/C3H5NO3/c1-2(4-7)3(5)6/h7H,1H3,(H,5,6)
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
11.43
Datawarrior
-1 » -2
11.43
OCHEM
-1 » -2
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization