pKahub
About
Molecules
Datasets
Molecule ID:
mol15992
SMILES:
CN(C)C(=O)CS
InChI:
InChI=1S/C4H9NOS/c1-5(2)4(6)3-7/h7H,3H2,1-2H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
8.10
Datawarrior
0 » -1
8.10
QSARToolbox
0 » -1
8.10
OCHEM
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization