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Ligand

NameCHEMBL3560732
Molecular formulaC21H18BrF3N2O2
IUPAC name(E)-3-(4-bromophenyl)-1-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]prop-2-en-1-one
Molecular weight467.286
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.3
SynonymsSBI-0646757.0001
SCHEMBL16599000
SCHEMBL16599002
Inchi KeyJVETWFRRRLUMFM-XCVCLJGOSA-N
Inchi IDInChI=1S/C21H18BrF3N2O2/c22-18-8-1-15(2-9-18)3-10-19(28)26-11-13-27(14-12-26)20(29)16-4-6-17(7-5-16)21(23,24)25/h1-10H,11-14H2/b10-3+
PubChem CID46399493
ChEMBLCHEMBL3560732
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
482765G-protein coupled receptor 183P32249GPR183Homo sapiens (Human)361

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