FENOTEROL

/static/temp/default.svg Search structure
Synonyms
Status
Molecule Category Free-form
ATC G02CA03 R03AC04 R03CC04
UNII 22M9P70OQ9
EPA CompTox DTXSID4023046

Structure

InChI Key LSLYOANBFKQKPT-UHFFFAOYSA-N
Smiles CC(Cc1ccc(O)cc1)NCC(O)c1cc(O)cc(O)c1
InChI
InChI=1S/C17H21NO4/c1-11(6-12-2-4-14(19)5-3-12)18-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17-22H,6,10H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H21NO4
Molecular Weight 303.36
AlogP 2.06
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 6.0
Polar Surface Area 92.95
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 22.0

Pharmacology

Mechanism of Action Action Reference
Beta-2 adrenergic receptor agonist AGONIST PubMed PubMed PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Adrenergic receptor
18-19 60 100-139 126 -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 97.12-102.67
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cavia porcellus
18-19 60 - - -
Cricetulus griseus
- - - - 97.12-102.67
Homo sapiens
- - 100-139 126 -

Target Conservation

Protein: Beta-2 adrenergic receptor
Description: Beta-2 adrenergic receptor
Organism : Homo sapiens
P07550 ENSG00000169252

Related Entries

Cross References

Resources Reference
ChEBI 149226
ChEMBL CHEMBL32800
DrugBank DB01288
DrugCentral 1155
FDA SRS 22M9P70OQ9
Human Metabolome Database HMDB0015405
Guide to Pharmacology 557
PharmGKB PA10079
PubChem 688468
SureChEMBL SCHEMBL5009
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