Molecule ID: mol37985

SMILES: CCOc1cc(/C=C/C2=[N+](c3ccccc3)c3ccccc3C2(C)C)cc(Br)c1O

InChI: InChI=1S/C26H24BrNO2/c1-4-30-23-17-18(16-21(27)25(23)29)14-15-24-26(2,3)20-12-8-9-13-22(20)28(24)19-10-6-5-7-11-19/h5-17H,4H2,1-3H3/p+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.55 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization