Molecule ID: mol8953

SMILES: CC(=O)NO

InChI: InChI=1S/C2H5NO2/c1-2(4)3-5/h5H,1H3,(H,3,4)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.70 QSARToolbox 0 » -1
8.70 QSARToolbox 0 » -1
8.70 QSARToolbox 0 » -1
8.70 QSARToolbox 0 » -1
8.70 IUPAC digitized pKa 0 » -1
8.75 QSARToolbox 0 » -1
8.75 QSARToolbox 0 » -1
9.01 QSARToolbox 0 » -1
9.02 QSARToolbox 0 » -1
9.07 OCHEM 0 » -1
9.07 Datawarrior 0 » -1
9.20 QSARToolbox 0 » -1
9.35 QSARToolbox 0 » -1
9.35 QSARToolbox 0 » -1
9.35 QSARToolbox 0 » -1
9.36 AttenGpKa training set 0 » -1
9.37 QSARToolbox 0 » -1
9.40 QSARToolbox 0 » -1
9.40 QSARToolbox 0 » -1
9.40 QSARToolbox 0 » -1
9.40 IUPAC digitized pKa 0 » -1
9.42 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization