Molecule ID: mol37120

SMILES: O=C(NCCNC(=O)c1ccccc1C(=O)OO)c1ccccc1C(=O)OO

InChI: InChI=1S/C18H16N2O8/c21-15(11-5-1-3-7-13(11)17(23)27-25)19-9-10-20-16(22)12-6-2-4-8-14(12)18(24)28-26/h1-8,25-26H,9-10H2,(H,19,21)(H,20,22)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization