Molecule ID: mol19418
SMILES: CCCCCCCS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3c(C(N)=O)cccc23)c(OC)c1
InChI: InChI=1S/C28H32N4O4S/c1-3-4-5-6-9-17-37(34,35)32-19-15-16-24(25(18-19)36-2)31-26-20-11-7-8-14-23(20)30-27-21(26)12-10-13-22(27)28(29)33/h7-8,10-16,18,32H,3-6,9,17H2,1-2H3,(H2,29,33)(H,30,31)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.33 | Baltruschat ChEMBL | 1 » 0 |