pKahub
About
Molecules
Datasets
Molecule ID:
mol24487
SMILES:
NC1C2CC1C2
InChI:
InChI=1S/C5H9N/c6-5-3-1-4(5)2-3/h3-5H,1-2,6H2
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
9.30
AttenGpKa training set
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization