Molecule ID: mol35958

SMILES: O=C(O)C(=C1CCCC1)C(C(=O)O)=C(c1ccccc1)c1ccccc1

InChI: InChI=1S/C22H20O4/c23-21(24)19(17-13-7-8-14-17)20(22(25)26)18(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2,(H,23,24)(H,25,26)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.87 QSARToolbox -1 » -2
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Charge States and Microspecies Visualization