CHEMBL310335
SMILES | CCC[C@H]1CCCCC1NC1=NCCO1 |
InChIKey | WDSZUSABLKNHCZ-VUWPPUDQSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 210.2 |
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 |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 8.23 | 8.23 | 8.23 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 7.61 | 7.61 | 7.61 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 6.25 | 6.55 | 6.85 | ChEMBL |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 8.53 | 8.53 | 8.53 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α2B | ADA2B | Human | Adrenoceptors | A | pEC50 | 8.03 | 8.03 | 8.03 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pEC50 | 8.39 | 8.39 | 8.39 | ChEMBL |
α2A | ADA2A | Human | Adrenoceptors | A | pEC50 | 8.79 | 8.79 | 8.79 | ChEMBL |