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Name | CHEMBL389842 |
---|---|
Molecular formula | C19H23N5O3 |
IUPAC name | 7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,3-dimethyl-9H-purine-2,6,8-trione |
Molecular weight | 369.425 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 0.6 |
Synonyms | 7-{3-[1,2,3,4-tetrahydroisoquinolin-2-yl]-propyl}-1,3-dimethyl-7,9-dihydro-3H-purine-2,6,8-trione BDBM50213574 |
Inchi Key | BUYJPECXLSATLM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H23N5O3/c1-21-16-15(17(25)22(2)19(21)27)24(18(26)20-16)10-5-9-23-11-8-13-6-3-4-7-14(13)12-23/h3-4,6-7H,5,8-12H2,1-2H3,(H,20,26) |
PubChem CID | 44424671 |
ChEMBL | CHEMBL389842 |
IUPHAR | N/A |
BindingDB | 50213574 |
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 |
---|---|---|---|---|---|
33449 | 5-hydroxytryptamine receptor 1A | P19327 | Htr1a | Rattus norvegicus (Rat) | 422 |
33451 | 5-hydroxytryptamine receptor 2A | P14842 | Htr2a | Rattus norvegicus (Rat) | 471 |
33450 | 5-hydroxytryptamine receptor 7 | P32305 | Htr7 | Rattus norvegicus (Rat) | 448 |
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