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Name | CHEMBL506338 |
---|---|
Molecular formula | C32H30F5N3O6 |
IUPAC name | 2-[2-[2-fluoro-3-[1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-3-[(2R)-2-(methylamino)-2-phenylethyl]-2,4-dioxopyrimidin-5-yl]phenoxy]ethoxy]acetic acid |
Molecular weight | 647.599 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 2 |
XlogP | 2.2 |
Synonyms | BDBM50272672 (R)-2-(2-(3-(1-(2-fluoro-6-(trifluoromethyl)benzyl)-6-methyl-3-(2-(methylamino)-2-phenylethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-2-fluorophenoxy)ethoxy)acetic acid |
Inchi Key | ARERDXBHAZDIGD-VWLOTQADSA-N |
Inchi ID | InChI=1S/C32H30F5N3O6/c1-19-28(21-10-6-13-26(29(21)34)46-15-14-45-18-27(41)42)30(43)40(17-25(38-2)20-8-4-3-5-9-20)31(44)39(19)16-22-23(32(35,36)37)11-7-12-24(22)33/h3-13,25,38H,14-18H2,1-2H3,(H,41,42)/t25-/m0/s1 |
PubChem CID | 44587403 |
ChEMBL | CHEMBL506338 |
IUPHAR | N/A |
BindingDB | 50272672 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
12379 | Gonadotropin-releasing hormone receptor | P30968 | GNRHR | Homo sapiens (Human) | 328 |
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