CHEMBL1223750
SMILES | FC(F)(F)c1cccc(N2CCN(CCCCNc3nccc4ccccc34)CC2)c1 |
InChIKey | KFWSEMIBLPIBOC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 428.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 7.17 | 7.17 | 7.17 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 9.0 | 9.0 | 9.0 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.24 | 8.12 | 9.0 | ChEMBL |
H4 | HRH4 | Human | Histamine | A | pKi | 8.27 | 8.27 | 8.27 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |