CHEMBL1800963
SMILES | COc1ccc(C[C@@H](C)NC[C@H](O)c2cc(O)cc(O)c2)c2ccccc12 |
InChIKey | MLQLUFQBFMFXJO-SZNDQCEHSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 4 |
Rotatable bonds | 7 |
Molecular weight (Da) | 367.2 |
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 |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 6.55 | 7.43 | 7.88 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β2 | ADRB2 | Rat | Adrenoceptors | A | pEC50 | 7.8 | 7.8 | 7.8 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 8.41 | 8.41 | 8.41 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pIC50 | 8.4 | 8.4 | 8.4 | ChEMBL |