Molecule ID: mol11750
SMILES: O=C(O)CN(CC(=O)O)CC(O)C(O)CN(CC(=O)O)CC(=O)O
InChI: InChI=1S/C12H20N2O10/c15-7(1-13(3-9(17)18)4-10(19)20)8(16)2-14(5-11(21)22)6-12(23)24/h7-8,15-16H,1-6H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.20 | IUPAC digitized pKa | -1 » -2 |
| 3.18 | IUPAC digitized pKa | 0 » -1 |
| 7.52 | IUPAC digitized pKa | -2 » -3 |
| 9.26 | IUPAC digitized pKa | -3 » -4 |
| 11.24 | IUPAC digitized pKa | -4 » -5 |
| 11.79 | IUPAC digitized pKa | -5 » -6 |