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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

NameCHEMBL3958418
Molecular formulaC20H16FNO3S
IUPAC name2-(3-fluoro-5-phenylmethoxyphenyl)-3H-1,2-benzothiazole 1,1-dioxide
Molecular weight369.41
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.8
SynonymsBDBM50196395
SCHEMBL1724414
Inchi KeyHXCOHBFCXVAKHT-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H16FNO3S/c21-17-10-18(12-19(11-17)25-14-15-6-2-1-3-7-15)22-13-16-8-4-5-9-20(16)26(22,23)24/h1-12H,13-14H2
PubChem CID67134965
ChEMBLCHEMBL3958418
IUPHARN/A
BindingDB50196395
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
539150Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
539151Free fatty acid receptor 4Q5NUL3FFAR4Homo sapiens (Human)377

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