Molecule ID: mol21385
SMILES: CC(C)CN1C(=O)CN(Cc2ccc(-c3cccc(CN4CCS(=O)(=O)CC4)n3)cc2)C1=O
InChI: InChI=1S/C24H30N4O4S/c1-18(2)14-28-23(29)17-27(24(28)30)15-19-6-8-20(9-7-19)22-5-3-4-21(25-22)16-26-10-12-33(31,32)13-11-26/h3-9,18H,10-17H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.70 | Baltruschat ChEMBL | 1 » 0 |