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Name | CHEMBL3716623 |
---|---|
Molecular formula | C23H22N4O6S2 |
IUPAC name | 4-[4-[[6-methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)-1-benzofuran-4-yl]oxymethyl]-1,3-thiazol-2-yl]oxan-4-ol |
Molecular weight | 514.571 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 1 |
XlogP | 3.1 |
Synonyms | SCHEMBL15348935 4-(4-(((6-methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)benzofuran-4-yl)oxy)methyl)thiazol-2-yl)tetrahydro-2H-pyran-4-ol US9688695, 118 BDBM176085 CXAXQTROOVVLBS-UHFFFAOYSA-N |
Inchi Key | CXAXQTROOVVLBS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H22N4O6S2/c1-29-14-7-17(32-11-13-12-34-20(24-13)23(28)3-5-31-6-4-23)15-9-19(33-18(15)8-14)16-10-27-21(25-16)35-22(26-27)30-2/h7-10,12,28H,3-6,11H2,1-2H3 |
PubChem CID | 72191815 |
ChEMBL | CHEMBL3716623 |
IUPHAR | N/A |
BindingDB | 176085 |
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 |
---|---|---|---|---|---|
523068 | Proteinase-activated receptor 4 | Q96RI0 | F2RL3 | Homo sapiens (Human) | 385 |
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