Molecule ID: mol16684

SMILES: COc1ccc(-c2ccc(CCCNc3ccc(CN4CCCC(O)C4)cc3)nn2)cc1

InChI: InChI=1S/C26H32N4O2/c1-32-25-13-8-21(9-14-25)26-15-12-23(28-29-26)4-2-16-27-22-10-6-20(7-11-22)18-30-17-3-5-24(31)19-30/h6-15,24,27,31H,2-5,16-19H2,1H3

Experimental Macro pKa Values

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