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Name | CHEMBL173327 |
---|---|
Molecular formula | C13H16N6O2S |
IUPAC name | 1,3-dipropyl-8-(thiadiazol-5-yl)-7H-purine-2,6-dione |
Molecular weight | 320.371 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 2.5 |
Synonyms | 1,3-Dipropyl-8-(1,2,3-thiadiazol-5-yl)xanthine BDBM50005371 1,3-Dipropyl-8-[1,2,3]thiadiazol-5-yl-3,7-dihydro-purine-2,6-dione; Hydrate |
Inchi Key | FDEGXLXVDKZPRI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C13H16N6O2S/c1-3-5-18-11-9(12(20)19(6-4-2)13(18)21)15-10(16-11)8-7-14-17-22-8/h7H,3-6H2,1-2H3,(H,15,16) |
PubChem CID | 136046119 |
ChEMBL | CHEMBL173327 |
IUPHAR | N/A |
BindingDB | 50005371 |
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 |
---|---|---|---|---|---|
559638 | Adenosine receptor A1 | P47745 | ADORA1 | Cavia porcellus (Guinea pig) | 326 |
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