CHEMBL321492
SMILES | COc1c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc(Br)c2ccccc12 |
InChIKey | ZLQMLDGHTKCIRQ-ZHRRBRCNSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 452.1 |
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 |
D1 | DRD1 | Bovine | Dopamine | A | pKi | 5.33 | 5.37 | 5.4 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.57 | 8.07 | 8.57 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.41 | 6.65 | 6.89 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.54 | 6.72 | 6.87 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |