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Name | MLS000115918 |
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Molecular formula | C14H13N3O2S2 |
IUPAC name | 1-(5-methylfuran-2-yl)-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone |
Molecular weight | 319.397 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 2.9 |
Synonyms | AC1LEJJ6 1-(5-methyl-2-furyl)-2-{[4-methyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-ethanone CHEMBL1383317 STK734752 A3135/0132578 [ Show all ] |
Inchi Key | AAHHTLQERBOQHF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H13N3O2S2/c1-9-5-6-11(19-9)10(18)8-21-14-16-15-13(17(14)2)12-4-3-7-20-12/h3-7H,8H2,1-2H3 |
PubChem CID | 713182 |
ChEMBL | CHEMBL1383317 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
203 | Thyrotropin receptor | P16473 | TSHR | Homo sapiens (Human) | 764 |
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