Molecule ID: mol17664
SMILES: CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3ccccc23)cc1
InChI: InChI=1S/C20H17N3O2S/c1-26(24,25)23-15-12-10-14(11-13-15)21-20-16-6-2-4-8-18(16)22-19-9-5-3-7-17(19)20/h2-13,23H,1H3,(H,21,22)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.19 | OCHEM | 1 » 0 |
| 7.19 | Baltruschat ChEMBL | 1 » 0 |
| 7.19 | Baltruschat ChEMBL | 1 » 0 |
| 7.19 | Baltruschat ChEMBL | 1 » 0 |
| 7.19 | Baltruschat ChEMBL | 1 » 0 |
| 7.19 | Baltruschat ChEMBL | 1 » 0 |
| 7.19 | Baltruschat ChEMBL | 1 » 0 |
| 7.19 | Baltruschat ChEMBL | 1 » 0 |
| 7.19 | Baltruschat ChEMBL | 1 » 0 |