Molecule ID: mol20200
SMILES: CC(=O)Nc1ccccc1Nc1c2ccccc2nc2ccccc12
InChI: InChI=1S/C21H17N3O/c1-14(25)22-19-12-6-7-13-20(19)24-21-15-8-2-4-10-17(15)23-18-11-5-3-9-16(18)21/h2-13H,1H3,(H,22,25)(H,23,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.24 | Baltruschat ChEMBL | 1 » 0 |
| 7.24 | Baltruschat ChEMBL | 1 » 0 |