CHEMBL64566
SMILES | COc1ccc(Br)cc1-c1nc(CNC[C@@H]2CCN(Cc3ccccc3)C2)c[nH]1 |
InChIKey | XWPFAYFZWMVJSL-SFHVURJKSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 8 |
Molecular weight (Da) | 454.1 |
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 | 5.05 | 5.05 | 5.05 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 5.96 | 5.96 | 5.96 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.89 | 5.89 | 5.89 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.2 | 5.38 | 5.56 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |