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Ligand

NameCHEMBL3974566
Molecular formulaC21H21F3N2O3
IUPAC name1-(2,6-dimethylphenyl)-N-[3-methoxy-5-(trifluoromethyl)phenyl]-5-oxopyrrolidine-3-carboxamide
Molecular weight406.405
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.4
SynonymsSCHEMBL12728306
Inchi KeyHOMFPISZZYQNIE-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H21F3N2O3/c1-12-5-4-6-13(2)19(12)26-11-14(7-18(26)27)20(28)25-16-8-15(21(22,23)24)9-17(10-16)29-3/h4-6,8-10,14H,7,11H2,1-3H3,(H,25,28)
PubChem CID68365555
ChEMBLCHEMBL3974566
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
538964Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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