pKahub
About
Molecules
Datasets
Molecule ID:
mol24465
SMILES:
CNCC(C)N
InChI:
InChI=1S/C4H12N2/c1-4(5)3-6-2/h4,6H,3,5H2,1-2H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
10.00
AttenGpKa training set
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization