Molecule ID: mol20190
SMILES: CS(=O)(=O)NCc1ccccc1Nc1c2ccccc2nc2ccccc12
InChI: InChI=1S/C21H19N3O2S/c1-27(25,26)22-14-15-8-2-5-11-18(15)24-21-16-9-3-6-12-19(16)23-20-13-7-4-10-17(20)21/h2-13,22H,14H2,1H3,(H,23,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.17 | Baltruschat ChEMBL | 1 » 0 |
| 7.17 | Baltruschat ChEMBL | 1 » 0 |