CHEMBL179648
SMILES | c1ccc(CN2CCN(CC3CCc4ccccc4O3)CC2)cc1 |
InChIKey | AJZBPCAHQHCXMX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 322.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 6.75 | 6.95 | 7.14 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 7.68 | 7.7 | 7.71 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 8.44 | 8.44 | 8.44 | ChEMBL |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 6.78 | 6.8 | 6.83 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 7.68 | 7.68 | 7.68 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |