Molecule ID: mol17436
SMILES: CCN(CC)CCOc1ccc(C(=O)N2C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)C2)cc1
InChI: InChI=1S/C32H32N4O7/c1-3-33(4-2)17-18-43-30-15-9-25(10-16-30)32(38)34-21-26(19-23-5-11-28(12-6-23)35(39)40)31(37)27(22-34)20-24-7-13-29(14-8-24)36(41)42/h5-16,19-20H,3-4,17-18,21-22H2,1-2H3/b26-19+,27-20+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.84 | Baltruschat ChEMBL | 1 » 0 |