CHEMBL564688
| SMILES | Cn1c(N2CCCC2)nc2c(CN3CCN(c4ccc(Cl)c(Cl)c4)CC3)c[nH]c2c1=O |
| InChIKey | VXWWHYWZTKORBH-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 460.2 |
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 |
| D2 | DRD2 | Human | Dopamine | A | pKi | 6.24 | 6.33 | 6.42 | PDSP Ki database |
| D2 | DRD2 | Human | Dopamine | A | pKi | 6.24 | 6.33 | 6.42 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 6.32 | 6.32 | 6.32 | PDSP Ki database |
| D3 | DRD3 | Human | Dopamine | A | pKi | 6.32 | 6.32 | 6.32 | ChEMBL |
| D4 | DRD4 | Human | Dopamine | A | pKi | 8.47 | 8.47 | 8.47 | ChEMBL |
| D1 | DRD1 | Bovine | Dopamine | A | pKi | 5.82 | 5.82 | 5.82 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |