CHEMBL366388
SMILES | O=C(CCCN1CCN(C2CCCc3ccccc32)CC1)c1ccc(F)cc1 |
InChIKey | JGHINESLHSSDOZ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 380.2 |
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 |
H1 | HRH1 | Rat | Histamine | A | pKi | 7.38 | 7.38 | 7.38 | ChEMBL |
α1A | ADA1A | Bovine | Adrenoceptors | A | pKi | 7.75 | 7.75 | 7.75 | ChEMBL |
D1 | DRD1 | Bovine | Dopamine | A | pKi | 6.0 | 6.0 | 6.0 | ChEMBL |
D2 | DRD2 | Bovine | Dopamine | A | pKi | 6.96 | 6.96 | 6.96 | ChEMBL |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 7.77 | 7.77 | 7.77 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pIC50 | 6.68 | 6.68 | 6.68 | ChEMBL |