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Ligand

NameCHEMBL55664
Molecular formulaC22H26N2O4S2
IUPAC name4-tert-butyl-N-[5-ethyl-4-(3-methoxyphenyl)sulfanyl-1,2-oxazol-3-yl]benzenesulfonamide
Molecular weight446.58
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP5.8
SynonymsBDBM50091525
N-[4-(3-Methoxyphenylthio)-5-ethylisoxazole-3-yl]-4-tert-butylbenzenesulfonamide
4-tert-Butyl-N-[5-ethyl-4-(3-methoxy-phenylsulfanyl)-isoxazol-3-yl]-benzenesulfonamide
Inchi KeyGBVIDTUQWWLRHG-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H26N2O4S2/c1-6-19-20(29-17-9-7-8-16(14-17)27-5)21(23-28-19)24-30(25,26)18-12-10-15(11-13-18)22(2,3)4/h7-14H,6H2,1-5H3,(H,23,24)
PubChem CID44298325
ChEMBLCHEMBL55664
IUPHARN/A
BindingDB50091525
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
92641Endothelin receptor type BP35463EDNRBSus scrofa (Pig)443
92640Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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