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Ligand

NameSCHEMBL1603530
Molecular formulaC22H20F6N2O2
IUPAC nameN-[3,5-bis(trifluoromethyl)phenyl]-3,4-dimethyl-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide
Molecular weight458.404
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP4.9
SynonymsCHEMBL3903453
SCHEMBL12728150
Inchi KeyHCWQBDPIQNCVFS-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H20F6N2O2/c1-12-6-4-5-7-17(12)30-11-20(3,13(2)18(30)31)19(32)29-16-9-14(21(23,24)25)8-15(10-16)22(26,27)28/h4-10,13H,11H2,1-3H3,(H,29,32)
PubChem CID51034890
ChEMBLCHEMBL3903453
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
538720Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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