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Name | CHEMBL1784050 |
---|---|
Molecular formula | C19H13FN4O2S |
IUPAC name | 5-(3-fluoro-4-methoxyphenyl)-13-(prop-2-ynylamino)-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one |
Molecular weight | 380.397 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 3.2 |
Synonyms | BDBM50345951 SCHEMBL8245801 3-(3-Fluoro-4-methoxy-phenyl)-9-prop-2-ynylamino-3H-pyrido[3'',2'':4,5]thieno[3,2-d]pyrimidin-4-one |
Inchi Key | CSZHNKILGMSWKB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H13FN4O2S/c1-3-7-21-13-6-8-22-18-15(13)16-17(27-18)19(25)24(10-23-16)11-4-5-14(26-2)12(20)9-11/h1,4-6,8-10H,7H2,2H3,(H,21,22) |
PubChem CID | 54585850 |
ChEMBL | CHEMBL1784050 |
IUPHAR | N/A |
BindingDB | 50345951 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
49906 | Metabotropic glutamate receptor 1 | Q13255 | GRM1 | Homo sapiens (Human) | 1194 |
49907 | Metabotropic glutamate receptor 1 | P23385 | Grm1 | Rattus norvegicus (Rat) | 1199 |
49905 | Metabotropic glutamate receptor 5 | P41594 | GRM5 | Homo sapiens (Human) | 1212 |
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