Molecule ID: mol20134

SMILES: CC(C)c1cc(C(=O)N2Cc3ccc(NC4CCNCC4)cc3C2)c(O)cc1O

InChI: InChI=1S/C23H29N3O3/c1-14(2)19-10-20(22(28)11-21(19)27)23(29)26-12-15-3-4-18(9-16(15)13-26)25-17-5-7-24-8-6-17/h3-4,9-11,14,17,24-25,27-28H,5-8,12-13H2,1-2H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.20 Baltruschat ChEMBL -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization