Molecule ID: mol20459
SMILES: Cc1cc(C)c2nc(-c3ccncc3)cc(C(=O)Nc3ccc4ccccc4c3)c2c1
InChI: InChI=1S/C27H21N3O/c1-17-13-18(2)26-23(14-17)24(16-25(30-26)20-9-11-28-12-10-20)27(31)29-22-8-7-19-5-3-4-6-21(19)15-22/h3-16H,1-2H3,(H,29,31)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.27 | Baltruschat ChEMBL | 1 » 0 |