Molecule ID: mol37281

SMILES: C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)CN)C(=O)O

InChI: InChI=1S/C12H20N4O5/c1-7(12(20)21)15-11(19)8-3-2-4-16(8)10(18)6-14-9(17)5-13/h7-8H,2-6,13H2,1H3,(H,14,17)(H,15,19)(H,20,21)/t7-,8-/m0/s1

Experimental Macro pKa Values

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