pKahub
About
Molecules
Datasets
Molecule ID:
mol175
SMILES:
CCNC
InChI:
InChI=1S/C3H9N/c1-3-4-2/h4H,3H2,1-2H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
10.90
OCHEM
1 » 0
10.90
AvLiLuMoVe
1 » 0
10.90
Settimo
1 » 0
10.90
AttenGpKa training set
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization