pKahub
About
Molecules
Datasets
Molecule ID:
mol12449
SMILES:
COCCSC(C)O
InChI:
InChI=1S/C5H12O2S/c1-5(6)8-4-3-7-2/h5-6H,3-4H2,1-2H3
Experimental Macro pKa Values
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TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
14.21
Datawarrior
0 » -1
14.21
OCHEM
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization