Molecule ID: mol19774

SMILES: CN(CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)cc1)CC1CC1

InChI: InChI=1S/C24H30BrNO2/c1-26(18-19-6-7-19)16-4-2-3-5-17-28-23-14-10-21(11-15-23)24(27)20-8-12-22(25)13-9-20/h8-15,19H,2-7,16-18H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
9.37 Baltruschat ChEMBL 1 » 0
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Charge States and Microspecies Visualization