CHEMBL229476
SMILES | C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1cc(O)cc(O)c1 |
InChIKey | LSLYOANBFKQKPT-GTNSWQLSSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 5 |
Rotatable bonds | 6 |
Molecular weight (Da) | 303.1 |
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 | 4.72 | 4.72 | 4.72 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 5.43 | 5.95 | 6.74 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pKd | 5.43 | 5.43 | 5.43 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β2 | ADRB2 | Rat | Adrenoceptors | A | pEC50 | 6.24 | 6.24 | 6.24 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 8.33 | 8.33 | 8.33 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pIC50 | 8.21 | 8.21 | 8.21 | ChEMBL |