Molecule ID: mol35877

SMILES: CCOC(=O)c1cc(C)nc(C)c1C(=O)O

InChI: InChI=1S/C11H13NO4/c1-4-16-11(15)8-5-6(2)12-7(3)9(8)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
4.68 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization