Molecule ID: mol2801

SMILES: CC/C(=C(\c1ccccc1)c1ccc(/C=C/C(=O)O)cc1)c1ccccc1

InChI: InChI=1S/C25H22O2/c1-2-23(20-9-5-3-6-10-20)25(21-11-7-4-8-12-21)22-16-13-19(14-17-22)15-18-24(26)27/h3-18H,2H2,1H3,(H,26,27)/b18-15+,25-23-

Experimental Macro pKa Values

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