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Name | Apafant |
---|---|
Molecular formula | C22H22ClN5O2S |
IUPAC name | 3-[7-(2-chlorophenyl)-13-methyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-4-yl]-1-morpholin-4-ylpropan-1-one |
Molecular weight | 455.961 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 1.1 |
Synonyms | NCGC00092377-04 SR-01000945084-1 (E)-3-(4-(2-chlorophenyl)-9-methyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-2-yl)-1-morpholinopropan-1-one WEB 2086BS 3-(4-(2-chlorophenyl)-9-methyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-2-yl)-1-morpholinopropan-1-one [ Show all ] |
Inchi Key | JGPJQFOROWSRRS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H22ClN5O2S/c1-14-25-26-19-13-24-21(16-4-2-3-5-18(16)23)17-12-15(31-22(17)28(14)19)6-7-20(29)27-8-10-30-11-9-27/h2-5,12H,6-11,13H2,1H3 |
PubChem CID | 65889 |
ChEMBL | CHEMBL280164 |
IUPHAR | 1859, 1860 |
BindingDB | 50000714 |
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 |
---|---|---|---|---|---|
150495 | Platelet-activating factor receptor | Q62035 | Ptafr | Mus musculus (Mouse) | 341 |
150496 | Platelet-activating factor receptor | P21556 | PTAFR | Cavia porcellus (Guinea pig) | 342 |
150497 | Platelet-activating factor receptor | P46002 | Ptafr | Rattus norvegicus (Rat) | 341 |
150498 | Platelet-activating factor receptor | P25105 | PTAFR | Homo sapiens (Human) | 342 |
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