Molecule ID: mol19390
SMILES: CCCCCCCS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3cc(NC(C)=O)ccc23)c(OC)c1
InChI: InChI=1S/C29H34N4O4S/c1-4-5-6-7-10-17-38(35,36)33-22-14-16-26(28(19-22)37-3)32-29-23-11-8-9-12-25(23)31-27-18-21(30-20(2)34)13-15-24(27)29/h8-9,11-16,18-19,33H,4-7,10,17H2,1-3H3,(H,30,34)(H,31,32)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.55 | Baltruschat ChEMBL | 1 » 0 |