Molecule ID: mol19381
SMILES: CCCCCS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3ccccc23)c(OC)c1
InChI: InChI=1S/C25H27N3O3S/c1-3-4-9-16-32(29,30)28-18-14-15-23(24(17-18)31-2)27-25-19-10-5-7-12-21(19)26-22-13-8-6-11-20(22)25/h5-8,10-15,17,28H,3-4,9,16H2,1-2H3,(H,26,27)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.39 | Baltruschat ChEMBL | 1 » 0 |