pKahub
About
Molecules
Datasets
Molecule ID:
mol7658
SMILES:
Nn1cnnc1
InChI:
InChI=1S/C2H4N4/c3-6-1-4-5-2-6/h1-2H,3H2
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
3.23
IUPAC digitized pKa
1 » 0
3.23
AttenGpKa training set
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization