Molecule ID: mol22200

SMILES: C/C(=N\O)C(=O)O

InChI: InChI=1S/C3H5NO3/c1-2(4-7)3(5)6/h7H,1H3,(H,5,6)/b4-2+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.33 AttenGpKa training set 0 » -1
11.43 QSARToolbox -1 » -2
11.61 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization