pKahub
About
Molecules
Datasets
Molecule ID:
mol24398
SMILES:
CCNC#N
InChI:
InChI=1S/C3H6N2/c1-2-5-3-4/h5H,2H2,1H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
1.20
AttenGpKa training set
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization