FORMOTEROL

Search structure
Synonyms:
Status: Approved (2001)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: R03AC13
UNII: 5ZZ84GCW8B

Structure
InChI Key BPZSYCZIITTYBL-UHFFFAOYSA-N
Smile COc1ccc(CC(C)NCC(O)c2ccc(O)c(NC=O)c2)cc1
InChI
InChI=1S/C19H24N2O4/c1-13(9-14-3-6-16(25-2)7-4-14)20-11-19(24)15-5-8-18(23)17(10-15)21-12-22/h3-8,10,12-13,19-20,23-24H,9,11H2,1-2H3,(H,21,22)

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H24N2O4
Molecular Weight 344.41
AlogP 2.22
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 9.0
Polar Surface Area 90.82
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 25.0

Pharmacology

Primary Target
β2-adrenoceptor
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
0-8 0-0 3 3-33 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Dopamine receptor
- - - 13000 -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Asthma 3 D001249 ClinicalTrials
Pulmonary Disease, Chronic Obstructive 3 D029424 ClinicalTrials
Alzheimer Disease 2 D000544 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 73573-87-2
ChEBI 63082
ChEMBL CHEMBL1256786
DrugBank DB00983
DrugCentral 1239
FDA SRS 5ZZ84GCW8B
Human Metabolome Database HMDB0015118
Guide to Pharmacology 3465
KEGG C07805
PharmGKB PA134687907
SureChEMBL SCHEMBL349579
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