CHEMBL1800961
SMILES | C[C@H](Cc1ccc2ccccc2c1)NC[C@H](O)c1cc(O)cc(O)c1 |
InChIKey | LGUXLVJQUKRZBO-SZNDQCEHSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 4 |
Rotatable bonds | 6 |
Molecular weight (Da) | 337.2 |
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 | 4.78 | 4.78 | 4.78 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 6.39 | 6.39 | 6.39 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 9.4 | 9.4 | 9.4 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pIC50 | 8.72 | 8.72 | 8.72 | ChEMBL |
β2 | ADRB2 | Rat | Adrenoceptors | A | pEC50 | 6.88 | 6.88 | 6.88 | ChEMBL |