Molecule ID: mol36145

SMILES: O=C(O)CN(CCCN(CC(=O)O)CC(=O)O)CCCN(CC(=O)O)CC(=O)O

InChI: InChI=1S/C16H27N3O10/c20-12(21)7-17(3-1-5-18(8-13(22)23)9-14(24)25)4-2-6-19(10-15(26)27)11-16(28)29/h1-11H2,(H,20,21)(H,22,23)(H,24,25)(H,26,27)(H,28,29)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.91 QSARToolbox -4 » -5
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Charge States and Microspecies Visualization