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Name | CHEMBL516370 |
---|---|
Molecular formula | C30H26F3N3O2 |
IUPAC name | 5-methoxy-N-[2-(pyridin-2-ylmethylamino)-2,3-dihydro-1H-inden-5-yl]-2-[4-(trifluoromethyl)phenyl]benzamide |
Molecular weight | 517.552 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 5.6 |
Synonyms | BDBM50277220 rac-4-methoxy-N-(2-(pyridin-2-ylmethylamino)-2,3-dihydro-1H-inden-5-yl)-4''-(trifluoromethyl)biphenyl-2-carboxamide |
Inchi Key | FZGJOQIUVBVNBJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H26F3N3O2/c1-38-26-11-12-27(19-5-8-22(9-6-19)30(31,32)33)28(17-26)29(37)36-23-10-7-20-14-25(16-21(20)15-23)35-18-24-4-2-3-13-34-24/h2-13,15,17,25,35H,14,16,18H2,1H3,(H,36,37) |
PubChem CID | 44591289 |
ChEMBL | CHEMBL516370 |
IUPHAR | N/A |
BindingDB | 50277220 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
90879 | Smoothened homolog | P56726 | Smo | Mus musculus (Mouse) | 793 |
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