CHEMBL4244929
SMILES | CC(=O)NCc1cccc(OC[C@@H](O)CNCCc2ccc(NC(=O)Cc3ccccc3)cc2)c1 |
InChIKey | OEUJCONLPXXQSV-SANMLTNESA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 4 |
Rotatable bonds | 13 |
Molecular weight (Da) | 475.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 8.34 | 8.34 | 8.34 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 5.21 | 5.21 | 5.21 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 4.8 | 4.8 | 4.8 | ChEMBL |