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Name | CHEMBL276545 |
---|---|
Molecular formula | C16H11ClN4O2 |
IUPAC name | 2-(4-chlorophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]quinoxaline-1,4-dione |
Molecular weight | 326.74 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 2.8 |
Synonyms | 2-(4-Chloro-phenyl)-5-methyl-2H,5H-[1,2,4]triazolo[4,3-a]quinoxaline-1,4-dione BDBM50086158 2-(4-Chlorophenyl)-5-methyl[1,2,4]triazolo[4,3-a]quinoxaline-1,4(2H,5H)-dione |
Inchi Key | CLKHKOVNJLVWFV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H11ClN4O2/c1-19-12-4-2-3-5-13(12)20-14(15(19)22)18-21(16(20)23)11-8-6-10(17)7-9-11/h2-9H,1H3 |
PubChem CID | 10830023 |
ChEMBL | CHEMBL276545 |
IUPHAR | N/A |
BindingDB | 50086158 |
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 |
---|---|---|---|---|---|
44803 | Adenosine receptor A1 | P28190 | ADORA1 | Bos taurus (Bovine) | 326 |
44805 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
44804 | Adenosine receptor A3 | P0DMS8 | ADORA3 | Homo sapiens (Human) | 318 |
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