Molecule ID: mol35062

SMILES: CC(C)C(C(=O)O)N(C)Cc1cccc(CN(C)C(C(=O)O)C(C)C)n1

InChI: InChI=1S/C19H31N3O4/c1-12(2)16(18(23)24)21(5)10-14-8-7-9-15(20-14)11-22(6)17(13(3)4)19(25)26/h7-9,12-13,16-17H,10-11H2,1-6H3,(H,23,24)(H,25,26)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.03 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization