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Name | 3-(2-thienyl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carboxylic acid |
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Molecular formula | C13H6F3NO2S2 |
IUPAC name | 3-thiophen-2-yl-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carboxylic acid |
Molecular weight | 329.311 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 4.0 |
Synonyms | 3-thiophen-2-yl-6-(trifluoromethyl)-2-thieno[3,2-b]pyridinecarboxylic acid SMR000338022 478080-13-6 HMS2642E17 AKOS005102725 [ Show all ] |
Inchi Key | DATGNBAKWXHSMN-UHFFFAOYSA-N |
Inchi ID | InChI=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 CID | 1486483 |
ChEMBL | CHEMBL1443201 |
IUPHAR | N/A |
BindingDB | 41616 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
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55333 | Sphingosine 1-phosphate receptor 2 | O95136 | S1PR2 | Homo sapiens (Human) | 353 |
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