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Name | CHEMBL3764191 |
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Molecular formula | C21H23F3N4OS2 |
IUPAC name | 4-[3-[(4-methyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-2-[4-(trifluoromethyl)phenyl]morpholine |
Molecular weight | 468.557 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 0 |
XlogP | 4.0 |
Synonyms | BDBM50139866 SCHEMBL18741893 |
Inchi Key | AGPVWRLINFFKSF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H23F3N4OS2/c1-27-19(16-7-12-30-14-16)25-26-20(27)31-11-2-8-28-9-10-29-18(13-28)15-3-5-17(6-4-15)21(22,23)24/h3-7,12,14,18H,2,8-11,13H2,1H3 |
PubChem CID | 127041673 |
ChEMBL | CHEMBL3764191 |
IUPHAR | N/A |
BindingDB | 50139866 |
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 |
---|---|---|---|---|---|
521609 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
521607 | D(3) dopamine receptor | P19020 | Drd3 | Rattus norvegicus (Rat) | 446 |
521608 | D(3) dopamine receptor | P35462 | DRD3 | Homo sapiens (Human) | 400 |
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