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Ligand

NameCHEMBL3890766
Molecular formulaC25H24F6N2O2
IUPAC nameN-[3,5-bis(trifluoromethyl)phenyl]-1-(2,6-dimethylphenyl)-3-(2-methylprop-2-enyl)-5-oxopyrrolidine-3-carboxamide
Molecular weight498.469
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP5.9
SynonymsSCHEMBL12728167
Inchi KeyILQUGNGBJUKKCV-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H24F6N2O2/c1-14(2)11-23(12-20(34)33(13-23)21-15(3)6-5-7-16(21)4)22(35)32-19-9-17(24(26,27)28)8-18(10-19)25(29,30)31/h5-10H,1,11-13H2,2-4H3,(H,32,35)
PubChem CID51034566
ChEMBLCHEMBL3890766
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
539432Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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