Molecule ID: mol22640

SMILES: O=C(O)CN(CC(=O)O)c1cccc2ccccc12

InChI: InChI=1S/C14H13NO4/c16-13(17)8-15(9-14(18)19)12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8-9H2,(H,16,17)(H,18,19)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.29 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization