CHEMBL3139316
| SMILES | Oc1ccc2c(c1)O[C@@H](CN1CCN(c3ccc(OCCF)cc3)CC1)CC2 |
| InChIKey | WYXKJCLEMKQLEU-OAQYLSRUSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 386.2 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| D5 | DRD5 | Human | Dopamine | A | pKi | 4.71 | 4.71 | 4.71 | ChEMBL |
| D4 | DRD4 | Human | Dopamine | A | pKi | 6.88 | 7.1 | 7.32 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 7.41 | 7.42 | 7.43 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |