Molecule ID: mol7448
SMILES: CCC1(c2ccccc2)C(=O)N(C(C)CN2CCOCC2)C(=O)N=C1O
InChI: InChI=1S/C19H25N3O4/c1-3-19(15-7-5-4-6-8-15)16(23)20-18(25)22(17(19)24)14(2)13-21-9-11-26-12-10-21/h4-8,14H,3,9-13H2,1-2H3,(H,20,23,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.63 | IUPAC digitized pKa | 1 » 0 |
| 8.49 | IUPAC digitized pKa | 0 » -1 |