Molecule ID: mol2716

SMILES: CCc1ccc(-c2ccc(Cl)cc2)cc1C1C(=O)CC2(CCOCC2)CC1=O

InChI: InChI=1S/C24H25ClO3/c1-2-16-3-4-18(17-5-7-19(25)8-6-17)13-20(16)23-21(26)14-24(15-22(23)27)9-11-28-12-10-24/h3-8,13,23H,2,9-12,14-15H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.86 Caine 0 » -1
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Charge States and Microspecies Visualization