Molecule ID: mol21533
SMILES: Cc1ccccc1C(=O)c1ccc2n1CCC2C(=O)O
InChI: InChI=1S/C16H15NO3/c1-10-4-2-3-5-11(10)15(18)14-7-6-13-12(16(19)20)8-9-17(13)14/h2-7,12H,8-9H2,1H3,(H,19,20)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.44 | Baltruschat ChEMBL | 0 » -1 |