Molecule ID: mol19466
SMILES: CN(C)Cc1ccc(O)c2ncccc12
InChI: InChI=1S/C12H14N2O/c1-14(2)8-9-5-6-11(15)12-10(9)4-3-7-13-12/h3-7,15H,8H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.47 | Baltruschat ChEMBL | 2 » 1 |
| 8.66 | Baltruschat ChEMBL | 0 » -1 |
| 9.46 | Baltruschat ChEMBL | 0 » -1 |