Molecule ID: mol36963

SMILES: O=C(O)CN(CC(=O)O)Cc1cc(CO)ccc1O

InChI: InChI=1S/C12H15NO6/c14-7-8-1-2-10(15)9(3-8)4-13(5-11(16)17)6-12(18)19/h1-3,14-15H,4-7H2,(H,16,17)(H,18,19)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
12.20 QSARToolbox -2 » -3
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization