Molecule ID: mol35429

SMILES: CCCN(CCC)C(=O)CN(C)c1c(C(=O)O)cnc2ccc(Cl)cc12

InChI: InChI=1S/C19H24ClN3O3/c1-4-8-23(9-5-2)17(24)12-22(3)18-14-10-13(20)6-7-16(14)21-11-15(18)19(25)26/h6-7,10-11H,4-5,8-9,12H2,1-3H3,(H,25,26)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.30 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization