mirabegron

Ligand id: 7445

Name: mirabegron

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 10
Topological polar surface area 128.51
Molecular weight 396.16
XLogP 3.83
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA and EMA (2012))
IUPAC Name
2-(2-amino-1,3-thiazol-4-yl)-N-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]amino]ethyl]phenyl]acetamide
International Nonproprietary Names
INN number INN
8907 mirabegron
Synonyms
Betmiga® | Myrbetriq® | YM-178
Database Links
CAS Registry No. 223673-61-8
ChEBI CHEBI:65349
ChEMBL Ligand CHEMBL2095212
DrugBank Ligand DB08893
PubChem CID 9865528
Search Google for chemical match using the InChIKey PBAPPPCECJKMCM-IBGZPJMESA-N
Search Google for chemicals with the same backbone PBAPPPCECJKMCM
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Search UniChem for chemical match using the InChIKey PBAPPPCECJKMCM-IBGZPJMESA-N
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Wikipedia Mirabegron
Comments
Mirabegron is a β3-adrenoceptor agonist muscle relaxant.