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Name | CHEMBL1096532 |
---|---|
Molecular formula | C22H25F3N6 |
IUPAC name | 5-piperidin-1-yl-7-[[3-(trifluoromethyl)phenyl]methyl]-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine |
Molecular weight | 430.479 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 4.0 |
Synonyms | 5-(piperidin-1-yl)-7-(3-(trifluoromethyl)benzyl)-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridin-1-amine BDBM50317463 |
Inchi Key | MCTOAQPVGVJEQA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H25F3N6/c23-22(24,25)15-6-4-5-14(11-15)12-30-10-7-16-17(13-30)21(31-8-2-1-3-9-31)27-20-18(16)19(26)28-29-20/h4-6,11H,1-3,7-10,12-13H2,(H3,26,27,28,29) |
PubChem CID | 46887916 |
ChEMBL | CHEMBL1096532 |
IUPHAR | N/A |
BindingDB | 50317463 |
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 |
---|---|---|---|---|---|
202333 | Bombesin receptor subtype-3 | P32247 | BRS3 | Homo sapiens (Human) | 399 |
202334 | Bombesin receptor subtype-3 | Q8K418 | Brs3 | Rattus norvegicus (Rat) | 399 |
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