pKahub
About
Molecules
Datasets
Molecule ID:
mol4287
SMILES:
Cn1nccn1
InChI:
InChI=1S/C3H5N3/c1-6-4-2-3-5-6/h2-3H,1H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
-3.50
AttenGpKa training set
2 » 1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization