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Ligand

Name3-(2-thienyl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carboxylic acid
Molecular formulaC13H6F3NO2S2
IUPAC name3-thiophen-2-yl-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carboxylic acid
Molecular weight329.311
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP4.0
SynonymsAKOS005102725
MLS000755154
3-thiophen-2-yl-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carboxylic acid
CHEMBL1443201
SR-01000742639-2
[ Show all ]
Inchi KeyDATGNBAKWXHSMN-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H6F3NO2S2/c14-13(15,16)6-4-8-10(17-5-6)9(7-2-1-3-20-7)11(21-8)12(18)19/h1-5H,(H,18,19)
PubChem CID1486483
ChEMBLCHEMBL1443201
IUPHARN/A
BindingDB41616
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
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GLASS IDNameUniProtGeneSpeciesLength
55333Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353

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