CHEMBL514591
SMILES | O=C(CCCN1CC2CC1N(c1ccc(Cl)cc1)C2)c1ccc(F)cc1 |
InChIKey | ZBMQPMVISGXIDJ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 372.1 |
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 | 6.29 | 6.29 | 6.29 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.66 | 6.66 | 6.66 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.77 | 6.77 | 6.77 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.77 | 6.77 | 6.77 | PDSP Ki database |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.66 | 6.66 | 6.66 | PDSP Ki database |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.29 | 6.29 | 6.29 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |