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Name | CHEMBL98678 |
---|---|
Molecular formula | C16H11ClN4O2 |
IUPAC name | 8-chloro-2-(4-methoxyphenyl)-5H-[1,2,4]triazolo[1,5-a]quinoxalin-4-one |
Molecular weight | 326.74 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 3.2 |
Synonyms | BDBM50039959 8-Chloro-2-(4-methoxy-phenyl)-5H-[1,2,4]triazolo[1,5-a]quinoxalin-4-one 2-(4-Methoxyphenyl)-8-chloro[1,2,4]triazolo[1,5-a]quinoxalin-4(5H)-one 8-chloro-2-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]quinoxalin-4(5H)-one |
Inchi Key | CRNSVOSEEIHNQB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H11ClN4O2/c1-23-11-5-2-9(3-6-11)14-19-15-16(22)18-12-7-4-10(17)8-13(12)21(15)20-14/h2-8H,1H3,(H,18,22) |
PubChem CID | 10449090 |
ChEMBL | CHEMBL98678 |
IUPHAR | N/A |
BindingDB | 50039959 |
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 |
---|---|---|---|---|---|
48939 | Adenosine receptor A1 | P28190 | ADORA1 | Bos taurus (Bovine) | 326 |
48941 | Adenosine receptor A1 | P30542 | ADORA1 | Homo sapiens (Human) | 326 |
48940 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
48938 | Adenosine receptor A3 | P0DMS8 | ADORA3 | Homo sapiens (Human) | 318 |
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