Molecule ID: mol21611
SMILES: COc1ccc2ccc(S(=O)(=O)NC3CCN(Cc4ccc5ccc(N)nc5c4)C3=O)cc2c1
InChI: InChI=1S/C25H24N4O4S/c1-33-20-7-4-17-5-8-21(14-19(17)13-20)34(31,32)28-22-10-11-29(25(22)30)15-16-2-3-18-6-9-24(26)27-23(18)12-16/h2-9,12-14,22,28H,10-11,15H2,1H3,(H2,26,27)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.30 | Baltruschat ChEMBL | 1 » 0 |