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Ligand

NameCHEMBL3903668
Molecular formulaC17H16O6S3
IUPAC name2-[4-(benzenesulfonyl)phenyl]-6,7-dihydro-5H-1,4-dithiepine 1,1,4,4-tetraoxide
Molecular weight412.489
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP1.5
Synonyms2-[4-(Phenylsulfonyl)phenyl]-6,7-dihydro-5H-1,4-dithiepin 1,1,4,4-tetraoxide
Inchi KeyLZSGXBXULZMGCO-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H16O6S3/c18-24(19)11-4-12-25(20,21)17(13-24)14-7-9-16(10-8-14)26(22,23)15-5-2-1-3-6-15/h1-3,5-10,13H,4,11-12H2
PubChem CID91376438
ChEMBLCHEMBL3903668
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
541203Galanin receptor type 1P47211GALR1Homo sapiens (Human)349

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