Molecule ID: mol20832
SMILES: Cc1cccc(C)c1Nc1ccccc1CC(=O)O
InChI: InChI=1S/C16H17NO2/c1-11-6-5-7-12(2)16(11)17-14-9-4-3-8-13(14)10-15(18)19/h3-9,17H,10H2,1-2H3,(H,18,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.07 | Baltruschat ChEMBL | 0 » -1 |