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Compound Detail

CHEMBL1198857

VILANTEROL
💊 Approved Drug
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💊 Approved Drug
OCc1cc([C@@H](O)CNCCCCCCOCCOCc2c(Cl)cccc2Cl)ccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1198857
Name VILANTEROL
Phase Approved
Structure Type MOL
InChI Key DAFYYTQWSAWIGS-DEOSSOPVSA-N
Therapeutic ✓ Yes

Known Names

GW-642444 GW-642444X GW642444 GW642444X Vilanterol
0
Targets
0
Activities
0
Assay Types
1
PK Parameters
20
Publications
5
Known Names
2
Indications

Molecular Properties

486.4
MW (Da)
4.61
ALogP
6
HBA
4
HBD
91.2
PSA (Ų)
0.26
QED
0
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 2013
Availability Prescription
Chirality Single Enantiomer

Routes of Administration

Topical

Flags

Natural Product
USAN Stem -terol
USAN Year 2009

Extended Properties

Molecular Formula C24H33Cl2NO5
MW 486.44
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -0.17

Indications

Asthma Pulmonary Disease, Chronic Obstructive

Pharmacokinetic Data

Parameter Value Units Species
T1/2 18.0 hr Cavia porcellus

Literature References

PubMed DOI Target Context # Activities
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M2 2
37468498 10.1038/s41467-023-40064-9 Peroxisome proliferator-activated receptor gamma 2
37468498 10.1038/s41467-023-40064-9 Glucocorticoid receptor 2
37468498 10.1038/s41467-023-40064-9 Estrogen receptor 2
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 1A 2
37468498 10.1038/s41467-023-40064-9 Nuclear receptor subfamily 1 group I member 2 2
37468498 10.1038/s41467-023-40064-9 Cannabinoid receptor 1 2
37468498 10.1038/s41467-023-40064-9 Gamma-aminobutyric acid receptor subunit alpha-1/alpha-2/beta-2/gamma-2 2
37468498 10.1038/s41467-023-40064-9 Progesterone receptor 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
37468498 10.1038/s41467-023-40064-9 Alpha-2A adrenergic receptor 2
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 2A 2
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 2B 2
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 2C 1
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M1 1
37468498 10.1038/s41467-023-40064-9 Adenosine receptor A3 1
37468498 10.1038/s41467-023-40064-9 Adenosine receptor A1 1
37468498 10.1038/s41467-023-40064-9 Bile salt export pump 1
37468498 10.1038/s41467-023-40064-9 Neuronal acetylcholine receptor subunit alpha-4 1
37468498 10.1038/s41467-023-40064-9 Beta-1 adrenergic receptor 1

Data from ChEMBL 36 via Core Engine