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Ligand

NameCHEMBL1915014
Molecular formulaC17H17ClN2O3
IUPAC name1-[(5-chloro-2-propyl-1-benzofuran-7-yl)methyl]-5-methylpyrazole-3-carboxylic acid
Molecular weight332.784
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.3
SynonymsBDBM50419413
SCHEMBL4166641
AFJWGPROQZBGGB-UHFFFAOYSA-N
1-[(5-chloro-2-propyl-1-benzofuran-7-yl)methyl]-5-methyl-1H-pyrazole-3-carboxylic Acid
Inchi KeyAFJWGPROQZBGGB-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H17ClN2O3/c1-3-4-14-8-11-6-13(18)7-12(16(11)23-14)9-20-10(2)5-15(19-20)17(21)22/h5-8H,3-4,9H2,1-2H3,(H,21,22)
PubChem CID24785588
ChEMBLCHEMBL1915014
IUPHARN/A
BindingDB50419413
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
4216Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402

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