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Ligand

NameCHEMBL3894488
Molecular formulaC22H20F6N2O2
IUPAC nameN-[3,5-bis(trifluoromethyl)phenyl]-1-(2-ethyl-6-methylphenyl)-5-oxopyrrolidine-3-carboxamide
Molecular weight458.404
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP4.8
SynonymsSCHEMBL12728670
Inchi KeyBNCMPZBJEHVZQU-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H20F6N2O2/c1-3-13-6-4-5-12(2)19(13)30-11-14(7-18(30)31)20(32)29-17-9-15(21(23,24)25)8-16(10-17)22(26,27)28/h4-6,8-10,14H,3,7,11H2,1-2H3,(H,29,32)
PubChem CID88954763
ChEMBLCHEMBL3894488
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
536699Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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