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Name | CHEMBL3715995 |
---|---|
Molecular formula | C24H22F3N5O6S3 |
IUPAC name | 2-methoxy-6-[6-methoxy-4-[[2-[1-(trifluoromethylsulfonyl)piperidin-4-yl]-1,3-thiazol-4-yl]methoxy]-1-benzofuran-2-yl]imidazo[2,1-b][1,3,4]thiadiazole |
Molecular weight | 629.644 |
Hydrogen bond acceptor | 15 |
Hydrogen bond donor | 0 |
XlogP | 4.8 |
Synonyms | BDBM176081 SCHEMBL15357167 US9688695, 114 |
Inchi Key | BDZNBNNJQRTJAR-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H22F3N5O6S3/c1-35-15-7-18(16-9-20(38-19(16)8-15)17-10-32-22(29-17)40-23(30-32)36-2)37-11-14-12-39-21(28-14)13-3-5-31(6-4-13)41(33,34)24(25,26)27/h7-10,12-13H,3-6,11H2,1-2H3 |
PubChem CID | 72191506 |
ChEMBL | CHEMBL3715995 |
IUPHAR | N/A |
BindingDB | 176081 |
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 |
---|---|---|---|---|---|
522089 | Proteinase-activated receptor 4 | Q96RI0 | F2RL3 | Homo sapiens (Human) | 385 |
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