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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

NameMLS001124200
Molecular formulaC20H28N2O3S
IUPAC namecyclobutyl-[2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-2,3-dihydroindol-1-yl]methanone
Molecular weight376.515
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.2
SynonymsSMR000629026
MCULE-7177382977
AKOS001915345
CHEMBL1420613
CCG-168906
[ Show all ]
Inchi KeyABOAOLATMYDQNI-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H28N2O3S/c1-14-6-3-4-11-21(14)26(24,25)18-9-10-19-17(13-18)12-15(2)22(19)20(23)16-7-5-8-16/h9-10,13-16H,3-8,11-12H2,1-2H3
PubChem CID20911667
ChEMBLCHEMBL1420613
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
994Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
463074Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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