Molecule ID: mol21041

SMILES: COc1cccc(CN(CCN(CCN(C)C)Cc2ccccc2)Cc2ccccc2)c1

InChI: InChI=1S/C28H37N3O/c1-29(2)17-18-30(22-25-11-6-4-7-12-25)19-20-31(23-26-13-8-5-9-14-26)24-27-15-10-16-28(21-27)32-3/h4-16,21H,17-20,22-24H2,1-3H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.37 Baltruschat ChEMBL 3 » 2
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Charge States and Microspecies Visualization