CHEMBL550392
| SMILES | Cc1cc2nc(C)c(CN3CCN(c4ccccc4)CC3)n2c(C)n1 |
| InChIKey | DNBHELXBRXDBSY-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 335.2 |
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 | Bovine | Dopamine | A | pKi | 4.96 | 4.96 | 4.96 | ChEMBL |
| D4 | DRD4 | Human | Dopamine | A | pKi | 7.16 | 7.16 | 7.16 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 5.38 | 5.38 | 5.38 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 4.96 | 5.02 | 5.07 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 5.0 | 5.04 | 5.07 | PDSP Ki database |
| D3 | DRD3 | Human | Dopamine | A | pKi | 5.38 | 5.38 | 5.38 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |