CHEMBL313320
| SMILES | COc1ccc(Br)cc1C1=N[C@@H](CN2CCN(c3ccccc3)CC2)CO1 |
| InChIKey | LKDKZDZBTSCLCY-KRWDZBQOSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 429.1 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| D1 | DRD1 | Bovine | Dopamine | A | pKi | 5.05 | 5.38 | 5.7 | ChEMBL |
| D4 | DRD4 | Human | Dopamine | A | pKi | 5.8 | 6.11 | 6.41 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 5.28 | 5.64 | 6.0 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 5.66 | 6.27 | 6.96 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |