| Synonyms: | |
| Status: | Approved (2014) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | R03AC19 |
| UNII: | VD2YSN1AFD |
| InChI Key | COUYJEVMBVSIHV-SFHVURJKSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C21H26N2O5 |
| Molecular Weight | 386.45 |
| AlogP | 2.38 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 100.05 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 28.0 |
| Primary Target | |
|---|---|
| β2-adrenoceptor |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Pulmonary Disease, Chronic Obstructive | 3 | D029424 | ClinicalTrials |
| Asthma | 2 | D001249 | ClinicalTrials |
| Liver Diseases | 1 | D008107 | ClinicalTrials |
| Resources | Reference |
|---|---|
| CAS NUMBER | 868049-49-4 |
| ChEBI | 82700 |
| ChEMBL | CHEMBL605846 |
| DrugBank | DB09080 |
| DrugCentral | 4814 |
| FDA SRS | VD2YSN1AFD |
| Guide to Pharmacology | 7543 |
| PubChem | 11504295 |
| SureChEMBL | SCHEMBL560926 |
| ZINC | ZINC000034636383 |