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Ligand

NameCHEMBL3929013
Molecular formulaC26H24F6N2O4S
IUPAC nameN-[3,5-bis(trifluoromethyl)phenyl]-1-(2,6-dimethylphenyl)-3-(1,1-dioxo-3,6-dihydro-2H-thiopyran-4-yl)-5-oxopyrrolidine-3-carboxamide
Molecular weight574.538
Hydrogen bond acceptor10
Hydrogen bond donor1
XlogP3.7
SynonymsSCHEMBL12728427
Inchi KeyGSSFYRNBNMKNFN-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H24F6N2O4S/c1-15-4-3-5-16(2)22(15)34-14-24(13-21(34)35,17-6-8-39(37,38)9-7-17)23(36)33-20-11-18(25(27,28)29)10-19(12-20)26(30,31)32/h3-6,10-12H,7-9,13-14H2,1-2H3,(H,33,36)
PubChem CID51033567
ChEMBLCHEMBL3929013
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
538543Chemokine-like receptor 1Q99788CMKLR1Homo sapiens (Human)373

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