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Name | MLS000682668 |
---|---|
Molecular formula | C22H23F3N4OS |
IUPAC name | 2,5-dimethyl-4-(4-methylpiperidin-1-yl)-N-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide |
Molecular weight | 448.508 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 6.1 |
Synonyms | 2,5-dimethyl-4-(4-methylpiperidino)-N-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide EU-0099157 SR-01000590376-1 AKOS002109051 MLS-0267529.0001 [ Show all ] |
Inchi Key | BKBIFNJLMCCFLF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H23F3N4OS/c1-12-8-10-29(11-9-12)19-17-13(2)18(31-21(17)27-14(3)26-19)20(30)28-16-7-5-4-6-15(16)22(23,24)25/h4-7,12H,8-11H2,1-3H3,(H,28,30) |
PubChem CID | 4137233 |
ChEMBL | CHEMBL1406762 |
IUPHAR | N/A |
BindingDB | 57757 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
25628 | G-protein coupled receptor 55 | Q9Y2T6 | GPR55 | Homo sapiens (Human) | 319 |
25629 | Melanocortin receptor 4 | P32245 | MC4R | Homo sapiens (Human) | 332 |
25627 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
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