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Ligand

NameCHEMBL3927774
Molecular formulaC27H27NO5
IUPAC name4-[[cyclopropylmethyl-[4-(2-ethoxyphenoxy)benzoyl]amino]methyl]benzoic acid
Molecular weight445.515
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.0
SynonymsSCHEMBL16506601
US9464060, 34
ZINC584598318
BDBM251698
Inchi KeyONGMIZHEZHGEOT-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H27NO5/c1-2-32-24-5-3-4-6-25(24)33-23-15-13-21(14-16-23)26(29)28(17-19-7-8-19)18-20-9-11-22(12-10-20)27(30)31/h3-6,9-16,19H,2,7-8,17-18H2,1H3,(H,30,31)
PubChem CID117903014
ChEMBLCHEMBL3927774
IUPHARN/A
BindingDB251698
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
542496Lysophosphatidic acid receptor 5Q9H1C0LPAR5Homo sapiens (Human)372

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