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Ligand

NameCHEMBL558671
Molecular formulaC21H27NO4S
IUPAC name7-[methylsulfonyl-[(4-phenylphenyl)methyl]amino]heptanoic acid
Molecular weight389.51
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.7
Synonyms7-(N-(biphenyl-4-ylmethyl)methylsulfonamido)heptanoic acid
BDBM50293503
SCHEMBL5726680
Inchi KeyDBNKUVNDIMWAQJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H27NO4S/c1-27(25,26)22(16-8-3-2-7-11-21(23)24)17-18-12-14-20(15-13-18)19-9-5-4-6-10-19/h4-6,9-10,12-15H,2-3,7-8,11,16-17H2,1H3,(H,23,24)
PubChem CID22246983
ChEMBLCHEMBL558671
IUPHARN/A
BindingDB50293503
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
55843Prostaglandin E2 receptor EP2 subtypeQ62928Ptger2Rattus norvegicus (Rat)357
55844Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488

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