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Name | CHEMBL327853 |
---|---|
Molecular formula | C13H7ClN4O2 |
IUPAC name | 8-chloro-2-(furan-3-yl)-5H-[1,2,4]triazolo[1,5-a]quinoxalin-4-one |
Molecular weight | 286.675 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 2.3 |
Synonyms | BDBM50039956 8-chloro-2-(furan-3-yl)-[1,2,4]triazolo[1,5-a]quinoxalin-4(5H)-one 2-(3-Furyl)-8-chloro[1,2,4]triazolo[1,5-a]quinoxalin-4(5H)-one 8-Chloro-2-furan-3-yl-5H-[1,2,4]triazolo[1,5-a]quinoxalin-4-one |
Inchi Key | CUIKPBVRWVBNLW-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C13H7ClN4O2/c14-8-1-2-9-10(5-8)18-12(13(19)15-9)16-11(17-18)7-3-4-20-6-7/h1-6H,(H,15,19) |
PubChem CID | 10062568 |
ChEMBL | CHEMBL327853 |
IUPHAR | N/A |
BindingDB | 50039956 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
50781 | Adenosine receptor A1 | P28190 | ADORA1 | Bos taurus (Bovine) | 326 |
50784 | Adenosine receptor A1 | P30542 | ADORA1 | Homo sapiens (Human) | 326 |
50783 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
50782 | Adenosine receptor A3 | P0DMS8 | ADORA3 | Homo sapiens (Human) | 318 |
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