CHEMBL303538
SMILES | N#CC(C#N)=Cc1ccc(CN2CCN(c3ccc(Cl)cc3)CC2)[nH]1 |
InChIKey | HEBQIUNCEBCMFD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 351.1 |
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 | 7.96 | 7.96 | 7.96 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 4.51 | 4.51 | 4.51 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 4.23 | 4.27 | 4.31 | ChEMBL |
D1 | DRD1 | Bovine | Dopamine | A | pKi | 4.4 | 4.4 | 4.4 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |