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Name | (2-(3-(((6-Methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)benzofuran-4-yl)oxy)methyl)phenyl)-5-methylthiazol-4-yl)methanol |
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Molecular formula | C26H22N4O5S2 |
IUPAC name | [2-[3-[[6-methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)-1-benzofuran-4-yl]oxymethyl]phenyl]-5-methyl-1,3-thiazol-4-yl]methanol |
Molecular weight | 534.605 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 1 |
XlogP | 4.9 |
Synonyms | CHEMBL3715863 BLRFHSIIVBBMQF-UHFFFAOYSA-N SCHEMBL15349862 US9518064, Example 106 BDBM286487 |
Inchi Key | BLRFHSIIVBBMQF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H22N4O5S2/c1-14-20(12-31)27-24(36-14)16-6-4-5-15(7-16)13-34-21-8-17(32-2)9-22-18(21)10-23(35-22)19-11-30-25(28-19)37-26(29-30)33-3/h4-11,31H,12-13H2,1-3H3 |
PubChem CID | 72192423 |
ChEMBL | CHEMBL3715863 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
522375 | Proteinase-activated receptor 4 | Q96RI0 | F2RL3 | Homo sapiens (Human) | 385 |
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