CHEMBL4302144
SMILES | COc1ccccc1CNCC(O)COc1cccc2c(=O)c3ccccc3oc12 |
InChIKey | TYLTZWFESLGJOS-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 8 |
Molecular weight (Da) | 405.2 |
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 |
β1 | ADRB1 | Rat | Adrenoceptors | A | pKi | 7.97 | 7.97 | 7.97 | ChEMBL |
β2 | ADRB2 | Guinea pig | Adrenoceptors | A | pKd | 6.94 | 6.94 | 6.94 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β1 | ADRB1 | Rat | Adrenoceptors | A | pIC50 | 6.75 | 6.75 | 6.75 | ChEMBL |