Molecule ID: mol18697
SMILES: NS(=O)(=O)Cc1ccc(Nc2c3ccccc3nc3ccccc23)cc1
InChI: InChI=1S/C20H17N3O2S/c21-26(24,25)13-14-9-11-15(12-10-14)22-20-16-5-1-3-7-18(16)23-19-8-4-2-6-17(19)20/h1-12H,13H2,(H,22,23)(H2,21,24,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.05 | Baltruschat ChEMBL | 1 » 0 |
| 7.05 | Baltruschat ChEMBL | 1 » 0 |