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Ligand

NameMLS001204131
Molecular formulaC19H11F3N2O2S2
IUPAC name2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-phenylacetic acid
Molecular weight420.424
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP5.0
SynonymsSMR000523835
(3-Cyano-6-thiophen-2-yl-4-trifluoromethyl-pyridin-2-ylsulfanyl)-phenyl-acetic acid
2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-phenylacetic acid
ABUKUMWSIDVZJQ-UHFFFAOYSA-N
AC1MKBWX
[ Show all ]
Inchi KeyABUKUMWSIDVZJQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H11F3N2O2S2/c20-19(21,22)13-9-14(15-7-4-8-27-15)24-17(12(13)10-23)28-16(18(25)26)11-5-2-1-3-6-11/h1-9,16H,(H,25,26)
PubChem CID3154832
ChEMBLCHEMBL1895167
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
1192Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
463105Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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