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Name | 2-methoxy-6-(6-methoxy-4-((6-(4-methoxytetrahydro-2H-pyran-4-yl)pyridin-2-yl)methoxy)benzofuran-2-yl)imidazo[2,1-b][1,3,4]thiadiazole |
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Molecular formula | C26H26N4O6S |
IUPAC name | 2-methoxy-6-[6-methoxy-4-[[6-(4-methoxyoxan-4-yl)pyridin-2-yl]methoxy]-1-benzofuran-2-yl]imidazo[2,1-b][1,3,4]thiadiazole |
Molecular weight | 522.576 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 0 |
XlogP | 3.5 |
Synonyms | AOERGMCIEVXOCP-UHFFFAOYSA-N CHEMBL3716902 BDBM286492 SCHEMBL15349802 US9518064, Example 111 |
Inchi Key | AOERGMCIEVXOCP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H26N4O6S/c1-31-17-11-20(35-15-16-5-4-6-23(27-16)26(33-3)7-9-34-10-8-26)18-13-22(36-21(18)12-17)19-14-30-24(28-19)37-25(29-30)32-2/h4-6,11-14H,7-10,15H2,1-3H3 |
PubChem CID | 72192122 |
ChEMBL | CHEMBL3716902 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
521729 | Proteinase-activated receptor 4 | Q96RI0 | F2RL3 | Homo sapiens (Human) | 385 |
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