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Name | CHEMBL3953985 |
---|---|
Molecular formula | C23H21F6N5 |
IUPAC name | 4,5-dimethyl-3-[4-(trifluoromethyl)phenyl]-6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]pyridazine |
Molecular weight | 481.446 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 0 |
XlogP | 5.3 |
Synonyms | SCHEMBL13490965 |
Inchi Key | GGAMUQQEZLZFLZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H21F6N5/c1-14-15(2)21(32-31-20(14)16-3-5-17(6-4-16)22(24,25)26)34-11-9-33(10-12-34)19-8-7-18(13-30-19)23(27,28)29/h3-8,13H,9-12H2,1-2H3 |
PubChem CID | 59191645 |
ChEMBL | CHEMBL3953985 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
538358 | Smoothened homolog | P56726 | Smo | Mus musculus (Mouse) | 793 |
538359 | Smoothened homolog | Q99835 | SMO | Homo sapiens (Human) | 787 |
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