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Ligand

NameCHEMBL559820
Molecular formulaC22H29NO4S
IUPAC name4-[4-[(4-butylphenyl)methyl-methylsulfonylamino]phenyl]butanoic acid
Molecular weight403.537
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.6
Synonyms4-(4-(N-(4-butylbenzyl)methylsulfonamido)phenyl)butanoic acid
BDBM50293510
Inchi KeyHPSJSGKFRUZCFJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H29NO4S/c1-3-4-6-18-9-11-20(12-10-18)17-23(28(2,26)27)21-15-13-19(14-16-21)7-5-8-22(24)25/h9-16H,3-8,17H2,1-2H3,(H,24,25)
PubChem CID45269576
ChEMBLCHEMBL559820
IUPHARN/A
BindingDB50293510
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
120942Prostaglandin E2 receptor EP2 subtypeQ62928Ptger2Rattus norvegicus (Rat)357
120943Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488

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