Molecule ID: mol37263

SMILES: C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O

InChI: InChI=1S/C18H34N6O6/c1-9(20)14(25)24-13(7-5-6-8-19)17(28)22-11(3)15(26)21-10(2)16(27)23-12(4)18(29)30/h9-13H,5-8,19-20H2,1-4H3,(H,21,26)(H,22,28)(H,23,27)(H,24,25)(H,29,30)/t9-,10-,11-,12-,13-/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.53 QSARToolbox 2 » 1
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Charge States and Microspecies Visualization