Molecule ID: mol16938

SMILES: Fc1ccc(Cc2ccc3c(NCCCNCc4ccco4)ccnc3c2)cc1

InChI: InChI=1S/C24H24FN3O/c25-20-7-4-18(5-8-20)15-19-6-9-22-23(10-13-28-24(22)16-19)27-12-2-11-26-17-21-3-1-14-29-21/h1,3-10,13-14,16,26H,2,11-12,15,17H2,(H,27,28)

Experimental Macro pKa Values

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