Molecule ID: mol19377
SMILES: CCCCCCS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3cc(NC(C)=O)ccc23)cc1
InChI: InChI=1S/C27H30N4O3S/c1-3-4-5-8-17-35(33,34)31-21-13-11-20(12-14-21)29-27-23-9-6-7-10-25(23)30-26-18-22(28-19(2)32)15-16-24(26)27/h6-7,9-16,18,31H,3-5,8,17H2,1-2H3,(H,28,32)(H,29,30)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.34 | Baltruschat ChEMBL | 1 » 0 |