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Name | CHEMBL3717630 |
---|---|
Molecular formula | C29H25FN4O5S2 |
IUPAC name | 6-[4-[[2-[4-(2-fluorophenyl)oxan-4-yl]-1,3-thiazol-4-yl]methoxy]-6-methoxy-1-benzofuran-2-yl]-2-methoxyimidazo[2,1-b][1,3,4]thiadiazole |
Molecular weight | 592.66 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 0 |
XlogP | 6.0 |
Synonyms | BDBM176123 SCHEMBL15349173 US9688695, 156 |
Inchi Key | AFGJFVIAINFEKH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H25FN4O5S2/c1-35-18-11-23(19-13-25(39-24(19)12-18)22-14-34-27(32-22)41-28(33-34)36-2)38-15-17-16-40-26(31-17)29(7-9-37-10-8-29)20-5-3-4-6-21(20)30/h3-6,11-14,16H,7-10,15H2,1-2H3 |
PubChem CID | 72193337 |
ChEMBL | CHEMBL3717630 |
IUPHAR | N/A |
BindingDB | 176123 |
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 |
---|---|---|---|---|---|
521565 | Proteinase-activated receptor 4 | Q96RI0 | F2RL3 | Homo sapiens (Human) | 385 |
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