CHEMBL284473
| SMILES | C=CCN1CCc2cc(O)c(O)cc2[C@@H](c2ccccc2)C1 |
| InChIKey | QBUVZVXIRYFENV-QGZVFWFLSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 295.2 |
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 |
| D1 | DRD1 | Human | Dopamine | A | pKi | 7.92 | 7.92 | 7.92 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| D1 | DRD1 | Rat | Dopamine | A | pEC50 | 7.6 | 7.6 | 7.6 | ChEMBL |
| D1 | DRD1 | Rat | Dopamine | A | pIC50 | 5.55 | 7.12 | 8.09 | ChEMBL |
| M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | Potency | 4.8 | 4.8 | 4.8 | ChEMBL |
| D2 | DRD2 | Rat | Dopamine | A | pIC50 | 5.3 | 5.59 | 5.85 | ChEMBL |
| D1 | DRD1 | Human | Dopamine | A | pEC50 | 9.0 | 9.0 | 9.0 | ChEMBL |