pKahub
About
Molecules
Datasets
Molecule ID:
mol15983
SMILES:
CCOC(C)=NO
InChI:
InChI=1S/C4H9NO2/c1-3-7-4(2)5-6/h6H,3H2,1-2H3
Experimental Macro pKa Values
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TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
11.37
QSARToolbox
0 » -1
11.37
Datawarrior
0 » -1
11.37
OCHEM
0 » -1
11.40
QSARToolbox
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization