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Name | CHEMBL2164226 |
---|---|
Molecular formula | C25H20F5N5O5S |
IUPAC name | 2-[3-[6-[4-(difluoromethoxy)phenyl]sulfonyl-2-(trifluoromethyl)-5,11-dihydropyrido[3,2-c][1,5]benzodiazepin-7-yl]-1,2,4-oxadiazol-5-yl]propan-2-ol |
Molecular weight | 597.517 |
Hydrogen bond acceptor | 15 |
Hydrogen bond donor | 2 |
XlogP | 4.5 |
Synonyms | BDBM50394606 |
Inchi Key | GZDCFEWELSMBGZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H20F5N5O5S/c1-24(2,36)22-33-21(34-40-22)16-4-3-5-17-19(16)35(12-13-6-11-18(25(28,29)30)32-20(13)31-17)41(37,38)15-9-7-14(8-10-15)39-23(26)27/h3-11,23,36H,12H2,1-2H3,(H,31,32) |
PubChem CID | 62707207 |
ChEMBL | CHEMBL2164226 |
IUPHAR | N/A |
BindingDB | 50394606 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
108889 | Bombesin receptor subtype-3 | O54798 | Brs3 | Mus musculus (Mouse) | 399 |
108890 | Bombesin receptor subtype-3 | P32247 | BRS3 | Homo sapiens (Human) | 399 |
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