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Ligand

NameCHEMBL3927309
Molecular formulaC23H24ClF3N2O2
IUPAC name(3S,4S)-N-[3-chloro-5-(trifluoromethyl)phenyl]-1-(2,6-dimethylphenyl)-3-ethyl-4-methyl-5-oxopyrrolidine-3-carboxamide
Molecular weight452.902
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.4
SynonymsSCHEMBL12706895
Inchi KeyITTHHSANLHMJGT-IVZQSRNASA-N
Inchi IDInChI=1S/C23H24ClF3N2O2/c1-5-22(21(31)28-18-10-16(23(25,26)27)9-17(24)11-18)12-29(20(30)15(22)4)19-13(2)7-6-8-14(19)3/h6-11,15H,5,12H2,1-4H3,(H,28,31)/t15-,22-/m1/s1
PubChem CID51033798
ChEMBLCHEMBL3927309
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
539594Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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