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Name | CHEMBL3717023 |
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Molecular formula | C24H21F3N4O4S2 |
IUPAC name | 2-methoxy-6-[6-methoxy-4-[[2-(1,4,4-trifluorocyclohexyl)-1,3-thiazol-4-yl]methoxy]-1-benzofuran-2-yl]imidazo[2,1-b][1,3,4]thiadiazole |
Molecular weight | 550.571 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 0 |
XlogP | 5.7 |
Synonyms | BDBM176103 CIDNRJHWKLRZDQ-UHFFFAOYSA-N SCHEMBL15349241 2-Methoxy-6-(6-methoxy-4-((2-(1,4,4-trifluorocyclohexyl)thiazol-4-yl)methoxy)benzofuran-2-yl)imidazo[2,1-b][1,3,4]thiadiazole US9688695, 136 |
Inchi Key | CIDNRJHWKLRZDQ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H21F3N4O4S2/c1-32-14-7-17(34-11-13-12-36-20(28-13)23(25)3-5-24(26,27)6-4-23)15-9-19(35-18(15)8-14)16-10-31-21(29-16)37-22(30-31)33-2/h7-10,12H,3-6,11H2,1-2H3 |
PubChem CID | 72192724 |
ChEMBL | CHEMBL3717023 |
IUPHAR | N/A |
BindingDB | 176103 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. 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 |
---|---|---|---|---|---|
522788 | Proteinase-activated receptor 4 | Q96RI0 | F2RL3 | Homo sapiens (Human) | 385 |
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