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Ligand

NameCHEMBL1081087
Molecular formulaC18H14F2N2O
IUPAC name(E)-3-(2,6-difluorophenyl)-1-[5-(2,5-dihydropyrrol-1-yl)pyridin-2-yl]prop-2-en-1-one
Molecular weight312.32
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.5
SynonymsN/A
Inchi KeyBJPCBXUIPGTZBB-VQHVLOKHSA-N
Inchi IDInChI=1S/C18H14F2N2O/c19-15-4-3-5-16(20)14(15)7-9-18(23)17-8-6-13(12-21-17)22-10-1-2-11-22/h1-9,12H,10-11H2/b9-7+
PubChem CID46880670
ChEMBLCHEMBL1081087
IUPHARN/A
BindingDBN/A
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
25333Proteinase-activated receptor 1P25116F2RHomo sapiens (Human)425

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