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Name | CHEMBL111933 |
---|---|
Molecular formula | C29H28F3N3O3 |
IUPAC name | 1-[(2,6-difluorophenyl)methyl]-3-[(2R)-1-[(3-fluorophenyl)methylamino]propan-2-yl]-5-(3-methoxyphenyl)-6-methylpyrimidine-2,4-dione |
Molecular weight | 523.556 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 4.7 |
Synonyms | 1-(2,6-Difluoro-benzyl)-3-[(R)-2-(3-fluoro-benzylamino)-1-methyl-ethyl]-5-(3-methoxy-phenyl)-6-methyl-1H-pyrimidine-2,4-dione BDBM50132749 1-(2,6-Difluorobenzyl)-3-[(R)-1-methyl-2-(3-fluorobenzylamino)ethyl]-5-(3-methoxyphenyl)-6-methyluracil |
Inchi Key | BNVVTOQKKGNWTP-GOSISDBHSA-N |
Inchi ID | InChI=1S/C29H28F3N3O3/c1-18(15-33-16-20-7-4-9-22(30)13-20)35-28(36)27(21-8-5-10-23(14-21)38-3)19(2)34(29(35)37)17-24-25(31)11-6-12-26(24)32/h4-14,18,33H,15-17H2,1-3H3/t18-/m1/s1 |
PubChem CID | 44340824 |
ChEMBL | CHEMBL111933 |
IUPHAR | N/A |
BindingDB | 50132749 |
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 |
---|---|---|---|---|---|
28481 | Gonadotropin-releasing hormone receptor | P30968 | GNRHR | Homo sapiens (Human) | 328 |
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