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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL2159474
Molecular formulaC16H17Cl3N2O3S2
IUPAC name5-chloro-N-[1-[2-(2,3-dichlorophenoxy)ethyl]pyrrolidin-3-yl]thiophene-2-sulfonamide
Molecular weight455.793
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.0
SynonymsBDBM50393380
Inchi KeyAFYGMVTVTLNALM-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H17Cl3N2O3S2/c17-12-2-1-3-13(16(12)19)24-9-8-21-7-6-11(10-21)20-26(22,23)15-5-4-14(18)25-15/h1-5,11,20H,6-10H2
PubChem CID71458650
ChEMBLCHEMBL2159474
IUPHARN/A
BindingDB50393380
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
46105-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
46115-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
46135-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
4612D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443

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