Molecule ID: mol33189
SMILES: CC(C=C(c1cccs1)c1cccs1)N1CCCC(=O)CCC1
InChI: InChI=1S/C19H23NOS2/c1-15(20-10-2-6-16(21)7-3-11-20)14-17(18-8-4-12-22-18)19-9-5-13-23-19/h4-5,8-9,12-15H,2-3,6-7,10-11H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.47 | QSARToolbox | 1 » 0 |
| 7.47 | OCHEM | 1 » 0 |