Molecule ID: mol20726
SMILES: Cc1ccc(C(=O)/C(=N/O)SCCN(C)C)cc1
InChI: InChI=1S/C13H18N2O2S/c1-10-4-6-11(7-5-10)12(16)13(14-17)18-9-8-15(2)3/h4-7,17H,8-9H2,1-3H3/b14-13-
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.76 | OCHEM | 1 » 0 |
| 7.76 | Baltruschat ChEMBL | 1 » 0 |