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Ligand

NameSCHEMBL931922
Molecular formulaC22H25FN4O2
IUPAC name5-fluoro-N,N-dimethyl-7-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]-1-benzofuran-2-carboxamide
Molecular weight396.466
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.1
Synonyms5-Fluoro-N,N-dimethyl-7-(4-(2-(pyridin-2-yl)ethyl)piperazin-1-yl)benzofuran-2-carboxamide
CHEMBL3650043
US8859534, 50
BDBM136364
LKUIEJVJQNPDKO-UHFFFAOYSA-N
Inchi KeyLKUIEJVJQNPDKO-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H25FN4O2/c1-25(2)22(28)20-14-16-13-17(23)15-19(21(16)29-20)27-11-9-26(10-12-27)8-6-18-5-3-4-7-24-18/h3-5,7,13-15H,6,8-12H2,1-2H3
PubChem CID59636734
ChEMBLCHEMBL3650043
IUPHARN/A
BindingDB136364
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
1899085-hydroxytryptamine receptor 1BP46636HTR1BCricetulus griseus (Chinese hamster)386

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