pKahub
About
Molecules
Datasets
Molecule ID:
mol15885
SMILES:
CC(C)([SeH])CN
InChI:
InChI=1S/C4H11NSe/c1-4(2,6)3-5/h6H,3,5H2,1-2H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
5.21
Datawarrior
1 » 0
5.21
QSARToolbox
1 » 0
10.95
Datawarrior
0 » -1
10.95
OCHEM
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization