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Ligand

NameCHEMBL174229
Molecular formulaC20H15NO4S
IUPAC name2-[2-cyano-5-(thiophen-3-ylmethoxy)phenoxy]-2-phenylacetic acid
Molecular weight365.403
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.0
Synonyms(RS)-[2-Cyano-5-(3-thienylmethoxy)phenoxy]phenylacetic acid
BDBM50085852
SCHEMBL8119563
(RS)-[2-Cyano-5-(3-thienylmethoxy)phenoxy]-phenylacetic Acid
[2-Cyano-5-(thiophen-3-ylmethoxy)-phenoxy]-phenyl-acetic acid
[ Show all ]
Inchi KeyAXRWHVQKSIEFTF-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H15NO4S/c21-11-16-6-7-17(24-12-14-8-9-26-13-14)10-18(16)25-19(20(22)23)15-4-2-1-3-5-15/h1-10,13,19H,12H2,(H,22,23)
PubChem CID9863916
ChEMBLCHEMBL174229
IUPHARN/A
BindingDB50085852
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
17024Endothelin receptor type BP21451EdnrbRattus norvegicus (Rat)442
17025Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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