Molecule ID: mol35876

SMILES: CCOC(=O)c1c(C(=O)O)cc(C)nc1C

InChI: InChI=1S/C11H13NO4/c1-4-16-11(15)9-7(3)12-6(2)5-8(9)10(13)14/h5H,4H2,1-3H3,(H,13,14)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.72 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization