Molecule ID: mol22740

SMILES: O=C(O)Cc1ccc(C(=O)O)c(O)c1

InChI: InChI=1S/C9H8O5/c10-7-3-5(4-8(11)12)1-2-6(7)9(13)14/h1-3,10H,4H2,(H,11,12)(H,13,14)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.96 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization