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Name | SCHEMBL2774146 |
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Molecular formula | C32H24F2N4O6S |
IUPAC name | 1-[[2,6-difluoro-4-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]methyl]-6-ethyl-3-[2-(4-methoxyphenyl)-2-oxoethyl]thieno[2,3-d]pyrimidine-2,4-dione |
Molecular weight | 630.623 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 1 |
XlogP | 5.9 |
Synonyms | AMDWDZCCHMYHJH-UHFFFAOYSA-N CHEMBL3640162 1-{[3,5-difluoro-2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl}-6-ethyl-3-[2-(4-methoxyphenyl)-2-oxoethyl]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione US8501750, 197 BDBM99984 [ Show all ] |
Inchi Key | AMDWDZCCHMYHJH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C32H24F2N4O6S/c1-3-20-14-23-29(40)37(16-27(39)17-8-10-19(43-2)11-9-17)32(42)38(30(23)45-20)15-24-25(33)12-18(13-26(24)34)21-6-4-5-7-22(21)28-35-31(41)44-36-28/h4-14H,3,15-16H2,1-2H3,(H,35,36,41) |
PubChem CID | 136052332 |
ChEMBL | CHEMBL3640162 |
IUPHAR | N/A |
BindingDB | 99984 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
8787 | Type-1 angiotensin II receptor | P30556 | AGTR1 | Homo sapiens (Human) | 359 |
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