CHEMBL388570
| SMILES | C[C@H](Cc1ccc(O)cc1)NC[C@H](O)c1cc(O)cc(O)c1 |
| InChIKey | LSLYOANBFKQKPT-DIFFPNOSSA-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 | 4.83 | 4.83 | 4.83 | ChEMBL |
| β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 6.46 | 7.24 | 8.4 | ChEMBL |
| β2 | ADRB2 | Human | Adrenoceptors | A | pKd | 6.46 | 6.46 | 6.46 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| β2 | ADRB2 | Rat | Adrenoceptors | A | pEC50 | 7.14 | 7.14 | 7.14 | ChEMBL |
| β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 9.52 | 9.52 | 9.52 | ChEMBL |
| β2 | ADRB2 | Human | Adrenoceptors | A | pIC50 | 9.85 | 9.85 | 9.85 | ChEMBL |