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Ligand

NameCHEMBL57680
Molecular formulaC19H13FN2O6S
IUPAC name3-[5-[(4-fluorophenyl)carbamoyl]-1-oxidopyridin-1-ium-2-yl]sulfonylbenzoic acid
Molecular weight416.379
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP1.4
Synonyms2-(3-Carboxyphenylsulfonyl)-5-(4-fluorophenylaminocarbonyl)pyridine 1-oxide
BDBM50102217
SCHEMBL3221470
3-[5-(4-Fluoro-phenylcarbamoyl)-1-oxy-pyridine-2-sulfonyl]-benzoic acid
Inchi KeyAFLYDJQMACMKQP-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H13FN2O6S/c20-14-5-7-15(8-6-14)21-18(23)13-4-9-17(22(26)11-13)29(27,28)16-3-1-2-12(10-16)19(24)25/h1-11H,(H,21,23)(H,24,25)
PubChem CID21878232
ChEMBLCHEMBL57680
IUPHARN/A
BindingDB50102217
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4273C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360

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