Molecule ID: mol37429

SMILES: CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)OC

InChI: InChI=1S/C17H29N3O3/c1-3-4-5-6-7-8-9-10-16(21)20-15(17(22)23-2)11-14-12-18-13-19-14/h12-13,15H,3-11H2,1-2H3,(H,18,19)(H,20,21)/t15-/m0/s1

Experimental Macro pKa Values

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