fenoterol
| SMILES | CC(Cc1ccc(cc1)O)NCC(c1cc(O)cc(c1)O)O |
| InChIKey | LSLYOANBFKQKPT-UHFFFAOYSA-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 | Yes |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| β1 | ADRB1 | Human | Adrenoceptors | A | pKi | 5.0 | 5.0 | 5.0 | Guide to Pharmacology |
| β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 5.5 | 6.25 | 7.0 | Guide to Pharmacology |
| β3 | ADRB3 | Human | Adrenoceptors | A | pKi | 5.4 | 5.4 | 5.4 | Guide to Pharmacology |
| β2 | ADRB2 | Guinea pig | Adrenoceptors | A | pKi | 6.29 | 6.3 | 6.31 | PDSP Ki database |
| β1 | H0W3H1 | Guinea pig | Adrenoceptors | A | pKi | 5.38 | 5.38 | 5.38 | PDSP Ki database |
| β2 | ADRB2 | Human | Adrenoceptors | A | pKd | 6.86 | 6.93 | 7.0 | ChEMBL |
| β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 6.9 | 6.9 | 6.9 | ChEMBL |
| β1 | ADRB1 | Human | Adrenoceptors | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
| β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 6.14 | 6.14 | 6.14 | PDSP Ki database |
| β3 | ADRB3 | Human | Adrenoceptors | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 7.5 | 7.5 | 7.5 | Guide to Pharmacology |
| β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 6.1 | 7.5 | 8.9 | Guide to Pharmacology |
| β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 7.6 | 7.6 | 7.6 | Guide to Pharmacology |
| β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 6.96 | 6.96 | 6.96 | ChEMBL |
| β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 8.16 | 8.16 | 8.16 | Drug Central |
| β2 | ADRB2 | Guinea pig | Adrenoceptors | A | pIC50 | 8.14 | 8.14 | 8.14 | Drug Central |
| NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 5.2 | 5.2 | 5.2 | ChEMBL |
| β2 | ADRB2 | Guinea pig | Adrenoceptors | A | pEC50 | 5.09 | 6.85 | 7.75 | ChEMBL |
| β2 | ADRB2 | Guinea pig | Adrenoceptors | A | pIC50 | 7.22 | 7.22 | 7.22 | ChEMBL |