Molecule ID: mol37738

SMILES: CC(O)COC(=O)[C@@H](N)Cc1ccc(O)c(O)c1

InChI: InChI=1S/C12H17NO5/c1-7(14)6-18-12(17)9(13)4-8-2-3-10(15)11(16)5-8/h2-3,5,7,9,14-16H,4,6,13H2,1H3/t7?,9-/m0/s1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization