Molecule ID: mol18587
SMILES: CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3ccc(N)cc23)cc1
InChI: InChI=1S/C20H18N4O2S/c1-27(25,26)24-15-9-7-14(8-10-15)22-20-16-4-2-3-5-18(16)23-19-11-6-13(21)12-17(19)20/h2-12,24H,21H2,1H3,(H,22,23)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.15 | OCHEM | 1 » 0 |
| 7.15 | Baltruschat ChEMBL | 1 » 0 |
| 7.15 | Baltruschat ChEMBL | 1 » 0 |
| 7.15 | Baltruschat ChEMBL | 1 » 0 |
| 7.15 | Baltruschat ChEMBL | 1 » 0 |