pKahub
About
Molecules
Datasets
Molecule ID:
mol15871
SMILES:
CCN[N+](=O)[O-]
InChI:
InChI=1S/C2H6N2O2/c1-2-3-4(5)6/h3H,2H2,1H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
6.31
AttenGpKa training set
0 » -1
6.39
OCHEM
0 » -1
6.39
Datawarrior
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization