pKahub
About
Molecules
Datasets
Molecule ID:
mol35086
SMILES:
CSCC(=O)C=NO
InChI:
InChI=1S/C4H7NO2S/c1-8-3-4(6)2-5-7/h2,7H,3H2,1H3
Experimental Macro pKa Values
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TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
8.16
QSARToolbox
0 » -1
10.04
QSARToolbox
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization