CHEMBL446892
SMILES | OC1(c2cccc(C(F)(F)F)c2)CCN(Cc2ccn(-c3ccccc3)c2)CC1 |
InChIKey | TVQJPTVBALUGFW-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 400.2 |
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 |
D3 | DRD3 | Green monkey | Dopamine | A | pKi | 6.38 | 6.38 | 6.38 | ChEMBL |
D2 | DRD2 | Green monkey | Dopamine | A | pKi | 6.62 | 6.62 | 6.62 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.31 | 6.31 | 6.31 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |