Molecule ID: mol37792
SMILES: NCC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC[C@H]1C(=O)NCC(=O)O
InChI: InChI=1S/C16H25N5O6/c17-7-12(22)20-5-1-3-10(20)15(26)18-8-13(23)21-6-2-4-11(21)16(27)19-9-14(24)25/h10-11H,1-9,17H2,(H,18,26)(H,19,27)(H,24,25)/t10-,11-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 11.67 | QSARToolbox | -2 » -3 |