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Name | CHEMBL238377 |
---|---|
Molecular formula | C43H49F2N13O6 |
IUPAC name | N-[[1-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]triazol-4-yl]methyl]-3-[[benzyl(methyl)amino]methyl]-8-[(2,6-difluorophenyl)methyl]-2-[4-(ethylcarbamoylamino)phenyl]-5-oxoimidazo[1,2-a]pyrimidine-6-carboxamide |
Molecular weight | 881.947 |
Hydrogen bond acceptor | 15 |
Hydrogen bond donor | 3 |
XlogP | 4.1 |
Synonyms | N/A |
Inchi Key | AQQAQZVUIQCLPO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C43H49F2N13O6/c1-3-47-42(61)50-32-14-12-31(13-15-32)39-38(29-55(2)25-30-8-5-4-6-9-30)58-41(60)35(28-56(43(58)51-39)27-34-36(44)10-7-11-37(34)45)40(59)48-24-33-26-57(54-52-33)17-19-63-21-23-64-22-20-62-18-16-49-53-46/h4-15,26,28H,3,16-25,27,29H2,1-2H3,(H,48,59)(H2,47,50,61) |
PubChem CID | 44434377 |
ChEMBL | CHEMBL238377 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
12009 | Gonadotropin-releasing hormone receptor | P30968 | GNRHR | Homo sapiens (Human) | 328 |
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