Molecule ID: mol37487
SMILES: O=[N+]([O-])c1ccc(N=Nc2cc3c(O)c(c2)COCCOCCOCCOCCOCCOC3)c([N+](=O)[O-])c1
InChI: InChI=1S/C24H30N4O11/c29-24-18-13-20(25-26-22-2-1-21(27(30)31)15-23(22)28(32)33)14-19(24)17-39-12-10-37-8-6-35-4-3-34-5-7-36-9-11-38-16-18/h1-2,13-15,29H,3-12,16-17H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.90 | QSARToolbox | 0 » -1 |