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Ligand

NameCHEMBL257829
Molecular formulaC20H19FN4O3S
IUPAC name4-[5-cyano-2-(4-fluorophenyl)-1H-indol-3-yl]-N-(methylsulfamoyl)butanamide
Molecular weight414.455
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP2.7
Synonyms4-[5-cyano-2-(4-fluorophenyl)-1H-indol-3-yl]-N-[(methylamino)sulfonyl]butanamide
BDBM50236295
Inchi KeyOEKBSTHRROXMTR-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19FN4O3S/c1-23-29(27,28)25-19(26)4-2-3-16-17-11-13(12-22)5-10-18(17)24-20(16)14-6-8-15(21)9-7-14/h5-11,23-24H,2-4H2,1H3,(H,25,26)
PubChem CID44447928
ChEMBLCHEMBL257829
IUPHARN/A
BindingDB50236295
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
239202C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360
239203C-X-C chemokine receptor type 2P35344CXCR2Oryctolagus cuniculus (Rabbit)358

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