Molecule ID: mol16566

SMILES: COc1cc(N)c(Cl)cc1C(=O)NC1CCN(Cc2ccccc2)CC1

InChI: InChI=1S/C20H24ClN3O2/c1-26-19-12-18(22)17(21)11-16(19)20(25)23-15-7-9-24(10-8-15)13-14-5-3-2-4-6-14/h2-6,11-12,15H,7-10,13,22H2,1H3,(H,23,25)

Experimental Macro pKa Values

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