CHEMBL212969
SMILES | CO/N=C(\CCN1CCN(c2ccccn2)CC1)c1ccc(F)cc1 |
InChIKey | BJBRHHUYMNBENN-RELWKKBWSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 342.2 |
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 |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.85 | 7.85 | 7.85 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.78 | 6.78 | 6.78 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D4 | DRD4 | Human | Dopamine | A | pEC50 | 7.31 | 7.31 | 7.31 | ChEMBL |