CHEMBL54206
SMILES | O=C(CCCN1CCC(O)(c2ccccc2)CC1)c1ccc(F)cc1 |
InChIKey | FEFFZKPQSVTBAY-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 341.2 |
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 |
D2 | DRD2 | Human | Dopamine | A | pKd | 8.07 | 8.07 | 8.07 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.12 | 8.12 | 8.12 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D1 | DRD1 | Rat | Dopamine | A | pIC50 | 5.55 | 5.55 | 5.55 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pIC50 | 7.33 | 7.33 | 7.33 | ChEMBL |