CHEMBL415080
SMILES | NC[C@@H]1OC(c2ccc(Br)cc2)Cc2c1ccc(O)c2O |
InChIKey | LDLAWZLGWDENOK-LOACHALJSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 3 |
Rotatable bonds | 2 |
Molecular weight (Da) | 349.0 |
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 | Rat | Dopamine | A | pKi | 7.28 | 7.28 | 7.28 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 5.68 | 5.68 | 5.68 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D2 | DRD2 | Rat | Dopamine | A | pEC50 | 6.45 | 6.45 | 6.45 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pEC50 | 8.99 | 8.99 | 8.99 | ChEMBL |