Molecule Details
| InChIKey | XNZHLLAIQAZMMY-BLLLJJGKSA-N |
|---|---|
| Compound Name | (S,S)-2-(3''-Chlorophenyl)-3,5,5-trimethyl-4-propylmorpholine |
| Canonical SMILES | CCCN1[C@@H](C)[C@](O)(c2cccc(Cl)c2)OCC1(C)C |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.78 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P23975 | SLC6A2 | Homo sapiens | Human | PF00209 | 7.9 | IC50 | ChEMBL;BindingDB |
| Q01959 | SLC6A3 | Homo sapiens | Human | PF00209 | 7.2 | IC50 | ChEMBL;BindingDB |
| P30926 | CHRNB4 | Homo sapiens | Human | PF02931 PF02932 | 6.0 | IC50 | ChEMBL |
| P32297 | CHRNA3 | Homo sapiens | Human | PF02931 PF02932 | 6.0 | IC50 | ChEMBL;BindingDB |