CHEMBL380287
SMILES | CN1CCN(c2ccc3nc(CN4CCN(c5ccc(Cl)c(Cl)c5)CC4)cn3n2)CC1 |
InChIKey | VSESOHHTOBROFA-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 459.2 |
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 | Pig | Dopamine | A | pKi | 4.89 | 4.89 | 4.89 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 5.72 | 5.72 | 5.72 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.06 | 6.06 | 6.06 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.1 | 5.11 | 5.11 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |