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Ligand

NameCHEMBL294095
Molecular formulaC14H13FN2O4S
IUPAC name6-ethylsulfonyl-N-(4-fluorophenyl)-1-oxidopyridin-1-ium-3-carboxamide
Molecular weight324.326
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP0.7
SynonymsSCHEMBL3218773
BDBM50102216
6-Ethanesulfonyl-N-(4-fluoro-phenyl)-1-oxy-nicotinamide
2-(Ethylsulfonyl)-5-(4-fluorophenylaminocarbonyl)pyridine 1-oxide
Inchi KeyGYTDPDSEJRDDCB-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H13FN2O4S/c1-2-22(20,21)13-8-3-10(9-17(13)19)14(18)16-12-6-4-11(15)5-7-12/h3-9H,2H2,1H3,(H,16,18)
PubChem CID9967031
ChEMBLCHEMBL294095
IUPHARN/A
BindingDB50102216
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
108612C-X-C chemokine receptor type 1P25024CXCR1Homo sapiens (Human)350
108613C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360
108614Calcitonin receptorP30988CALCRHomo sapiens (Human)508
108609Endothelin receptor type BP24530EDNRBHomo sapiens (Human)442
108611Gastrin/cholecystokinin type B receptorP32239CCKBRHomo sapiens (Human)447
108610Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384

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