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Name | CHEMBL229366 |
---|---|
Molecular formula | C24H33ClN6O3 |
IUPAC name | 7-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]-1,3-dimethyl-8-propoxypurine-2,6-dione |
Molecular weight | 489.017 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 3.7 |
Synonyms | BDBM50213587 |
Inchi Key | CTEWZVKBSGFDET-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H33ClN6O3/c1-4-16-34-23-26-21-20(22(32)28(3)24(33)27(21)2)31(23)11-6-5-10-29-12-14-30(15-13-29)19-9-7-8-18(25)17-19/h7-9,17H,4-6,10-16H2,1-3H3 |
PubChem CID | 44424662 |
ChEMBL | CHEMBL229366 |
IUPHAR | N/A |
BindingDB | 50213587 |
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 |
---|---|---|---|---|---|
50059 | 5-hydroxytryptamine receptor 1A | P19327 | Htr1a | Rattus norvegicus (Rat) | 422 |
50058 | 5-hydroxytryptamine receptor 2A | P14842 | Htr2a | Rattus norvegicus (Rat) | 471 |
50060 | 5-hydroxytryptamine receptor 7 | P32305 | Htr7 | Rattus norvegicus (Rat) | 448 |
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