Molecule ID: mol20733
SMILES: CCN(CC)CCS/C(=N\O)C(=O)c1ccccc1
InChI: InChI=1S/C14H20N2O2S/c1-3-16(4-2)10-11-19-14(15-18)13(17)12-8-6-5-7-9-12/h5-9,18H,3-4,10-11H2,1-2H3/b15-14-
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.60 | OCHEM | 1 » 0 |
| 7.60 | OCHEM | 1 » 0 |
| 7.60 | Baltruschat ChEMBL | 1 » 0 |