pKahub
About
Molecules
Datasets
Molecule ID:
mol2516
SMILES:
CC1CCN(C)CC1
InChI:
InChI=1S/C7H15N/c1-7-3-5-8(2)6-4-7/h7H,3-6H2,1-2H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
10.05
IUPAC digitized pKa
1 » 0
10.05
OCHEM
1 » 0
10.05
Hunt
1 » 0
10.05
OCHEM
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization