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Ligand

NameCHEMBL3918646
Molecular formulaC12H11F3O5S2
IUPAC name2-[4-(trifluoromethoxy)phenyl]-6,7-dihydro-5H-1,4-dithiepine 1,1,4,4-tetraoxide
Molecular weight356.33
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP1.9
Synonyms2-[4-(Trifluoromethoxy)phenyl]-6,7-dihydro-5H-1,4-dithiepin 1,1,4,4-tetraoxide
Inchi KeyDTGPZJQLCSOIOT-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H11F3O5S2/c13-12(14,15)20-10-4-2-9(3-5-10)11-8-21(16,17)6-1-7-22(11,18)19/h2-5,8H,1,6-7H2
PubChem CID90940684
ChEMBLCHEMBL3918646
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
537651Galanin receptor type 1P47211GALR1Homo sapiens (Human)349

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