Molecule ID: mol20000
SMILES: CN1C2COCC1CC(NC(=O)N1CC(C)(C)c3ccccc31)C2
InChI: InChI=1S/C19H27N3O2/c1-19(2)12-22(17-7-5-4-6-16(17)19)18(23)20-13-8-14-10-24-11-15(9-13)21(14)3/h4-7,13-15H,8-12H2,1-3H3,(H,20,23)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.10 | Baltruschat ChEMBL | 1 » 0 |