Molecule ID: mol15448
SMILES: O=[N+]([O-])c1ccc(O)c(CN2CCOCCOCCOCCOCCOCC2)c1
InChI: InChI=1S/C19H30N2O8/c22-19-2-1-18(21(23)24)15-17(19)16-20-3-5-25-7-9-27-11-13-29-14-12-28-10-8-26-6-4-20/h1-2,15,22H,3-14,16H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.77 | QSARToolbox | 1 » 0 |
| 5.77 | Datawarrior | 1 » 0 |
| 5.77 | OCHEM | 1 » 0 |
| 9.59 | Datawarrior | 0 » -1 |
| 9.59 | OCHEM | 0 » -1 |