Molecule ID: mol34621

SMILES: COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2O)cc1

InChI: InChI=1S/C17H16O5/c1-21-12-6-3-11(4-7-12)5-8-14(18)17-15(19)9-13(22-2)10-16(17)20/h3-10,19-20H,1-2H3/b8-5+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization