Molecule ID: mol18709
SMILES: CNC(=O)Nc1ccc(Cc2c3ccccc3nc3ccccc23)cc1
InChI: InChI=1S/C22H19N3O/c1-23-22(26)24-16-12-10-15(11-13-16)14-19-17-6-2-4-8-20(17)25-21-9-5-3-7-18(19)21/h2-13H,14H2,1H3,(H2,23,24,26)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.77 | Baltruschat ChEMBL | 1 » 0 |