Molecule ID: mol16850

SMILES: COc1cccc(Oc2ccc3c(NCCCNCc4ccco4)ccnc3c2)c1

InChI: InChI=1S/C24H25N3O3/c1-28-18-5-2-6-19(15-18)30-20-8-9-22-23(10-13-27-24(22)16-20)26-12-4-11-25-17-21-7-3-14-29-21/h2-3,5-10,13-16,25H,4,11-12,17H2,1H3,(H,26,27)

Experimental Macro pKa Values

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