Synonyms: | |
Status: | Approved (1994) |
Entry Type: | Small molecule |
Molecule Category: | Parent |
ATC: | R03AC12 |
UNII: | 2I4BC502BT |
InChI Key | GIIZNNXWQWCKIB-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C25H37NO4 |
Molecular Weight | 415.57 |
AlogP | 4.11 |
Hydrogen Bond Acceptor | 5.0 |
Hydrogen Bond Donor | 4.0 |
Number of Rotational Bond | 16.0 |
Polar Surface Area | 81.95 |
Molecular species | BASE |
Aromatic Rings | 2.0 |
Heavy Atoms | 30.0 |
Primary Target | |
---|---|
β2-adrenoceptor |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Ion channel
Other ion channel
Pore-forming toxins (proteins and peptides)
|
- | - | - | - | 27 | |
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Monoamine receptor
Adrenergic receptor
|
0-1 | 4-4 | 0-1100 | 0-184 | - | |
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Monoamine receptor
Dopamine receptor
|
- | - | - | 1049 | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Pulmonary Disease, Chronic Obstructive | 3 | D029424 | ClinicalTrials |
Asthma | 3 | D001249 | ClinicalTrials |
Emphysema | 3 | D004646 | ClinicalTrials |
Bronchitis, Chronic | 3 | D029481 | ClinicalTrials |
Spinal Cord Injuries | 1 | D013119 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 89365-50-4 |
ChEBI | 64064 |
ChEMBL | CHEMBL1263 |
DrugBank | DB00938 |
DrugCentral | 2419 |
EPA CompTox | DTXSID6023571 |
FDA SRS | 2I4BC502BT |
Human Metabolome Database | HMDB0015073 |
Guide to Pharmacology | 559 |
KEGG | C07241 |
PharmGKB | PA451300 |
PubChem | 5152 |
SureChEMBL | SCHEMBL4767 |