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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

NameCHEMBL3798670
Molecular formulaC24H22ClN3O4S
IUPAC name4-tert-butyl-N-[7-chloro-2-(4-methylpyridin-2-yl)-1,3-dioxoisoindol-4-yl]benzenesulfonamide
Molecular weight483.967
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.5
SynonymsSCHEMBL16871196
Inchi KeyINJYKLLFMFXKKU-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H22ClN3O4S/c1-14-11-12-26-19(13-14)28-22(29)20-17(25)9-10-18(21(20)23(28)30)27-33(31,32)16-7-5-15(6-8-16)24(2,3)4/h5-13,27H,1-4H3
PubChem CID118204596
ChEMBLCHEMBL3798670
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
525482C-C chemokine receptor type 9P51686CCR9Homo sapiens (Human)369

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