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Name | SCHEMBL2775820 |
---|---|
Molecular formula | C29H28N4O6S |
IUPAC name | 6-ethyl-3-[(4-hydroxyoxan-4-yl)methyl]-1-[[4-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]methyl]thieno[2,3-d]pyrimidine-2,4-dione |
Molecular weight | 560.625 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 3.8 |
Synonyms | US8501750, 145 BDBM99969 CHEMBL3640148 6-ethyl-3-[(4-hydroxytetrahydro-2H-pyran-4-yl)methyl]-1-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl}thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione BKKFWGXZFDAGEO-UHFFFAOYSA-N |
Inchi Key | BKKFWGXZFDAGEO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H28N4O6S/c1-2-20-15-23-25(34)33(17-29(37)11-13-38-14-12-29)28(36)32(26(23)40-20)16-18-7-9-19(10-8-18)21-5-3-4-6-22(21)24-30-27(35)39-31-24/h3-10,15,37H,2,11-14,16-17H2,1H3,(H,30,31,35) |
PubChem CID | 136052268 |
ChEMBL | CHEMBL3640148 |
IUPHAR | N/A |
BindingDB | 99969 |
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 |
---|---|---|---|---|---|
25849 | Type-1 angiotensin II receptor | P30556 | AGTR1 | Homo sapiens (Human) | 359 |
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