CHEMBL574030
| SMILES | COc1ccc(-n2cc(C(=O)NCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)nn2)cc1 |
| InChIKey | UQQZLMXUYGQJIW-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 9 |
| Molecular weight (Da) | 502.2 |
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 | Pig | Dopamine | A | pKi | 6.33 | 6.33 | 6.33 | ChEMBL |
| D4 | DRD4 | Human | Dopamine | A | pKi | 6.62 | 6.62 | 6.62 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 7.34 | 7.34 | 7.34 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 5.77 | 6.54 | 7.31 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |