Molecule ID: mol37278

SMILES: C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)NCC(=O)CN)C(=O)O

InChI: InChI=1S/C13H25N7O5/c1-7(11(23)24)19-10(22)9(3-2-4-17-12(15)16)20-13(25)18-6-8(21)5-14/h7,9H,2-6,14H2,1H3,(H,19,22)(H,23,24)(H4,15,16,17)(H2,18,20,25)/t7-,9-/m0/s1

Experimental Macro pKa Values

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