Molecule ID: mol37637

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

InChI: InChI=1S/C16H29N5O6/c1-5-8(2)13(16(27)18-7-12(23)24)21-15(26)11(6-17)20-14(25)9(3)19-10(4)22/h8-9,11,13H,5-7,17H2,1-4H3,(H,18,27)(H,19,22)(H,20,25)(H,21,26)(H,23,24)/t8-,9-,11-,13-/m0/s1

Experimental Macro pKa Values

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