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Ligand

NameCHEMBL3977233
Molecular formulaC26H28F6N2O2
IUPAC nameN-[3,5-bis(trifluoromethyl)phenyl]-1-(2,6-dimethylphenyl)-3-(2-methylbutan-2-yl)-5-oxopyrrolidine-3-carboxamide
Molecular weight514.512
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP6.4
SynonymsSCHEMBL12728439
Inchi KeyIJZIHLPMMHPRLW-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H28F6N2O2/c1-6-23(4,5)24(13-20(35)34(14-24)21-15(2)8-7-9-16(21)3)22(36)33-19-11-17(25(27,28)29)10-18(12-19)26(30,31)32/h7-12H,6,13-14H2,1-5H3,(H,33,36)
PubChem CID51034116
ChEMBLCHEMBL3977233
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This 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
539397Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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