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Ligand

NameCHEMBL3928096
Molecular formulaC25H26F6N2O3
IUPAC name(3R)-N-[3,5-bis(trifluoromethyl)phenyl]-1-[2-(methoxymethyl)-6-methylphenyl]-5-oxo-3-propan-2-ylpyrrolidine-3-carboxamide
Molecular weight516.484
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP4.8
SynonymsSCHEMBL12728186
Inchi KeyHWLFTABCSRRLAA-QHCPKHFHSA-N
Inchi IDInChI=1S/C25H26F6N2O3/c1-14(2)23(11-20(34)33(13-23)21-15(3)6-5-7-16(21)12-36-4)22(35)32-19-9-17(24(26,27)28)8-18(10-19)25(29,30)31/h5-10,14H,11-13H2,1-4H3,(H,32,35)/t23-/m0/s1
PubChem CID51034684
ChEMBLCHEMBL3928096
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
539133Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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