pKahub
About
Molecules
Datasets
Molecule ID:
mol27517
SMILES:
NC(=O)N[N+](=O)[O-]
InChI:
InChI=1S/CH3N3O3/c2-1(5)3-4(6)7/h(H3,2,3,5)
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
4.19
AttenGpKa training set
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization