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Name | CHEMBL160817 |
---|---|
Molecular formula | C23H27N3O3 |
IUPAC name | 6-[4-(1,2-benzoxazol-3-yl)piperazin-1-yl]-1-(2-hydroxyphenyl)hexan-1-one |
Molecular weight | 393.487 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.6 |
Synonyms | BDBM50123697 6-(4-Benzo[d]isoxazol-3-yl-piperazin-1-yl)-1-(2-hydroxy-phenyl)-hexan-1-one |
Inchi Key | BWXABDUNWUIBLQ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H27N3O3/c27-20(18-8-3-5-11-21(18)28)10-2-1-7-13-25-14-16-26(17-15-25)23-19-9-4-6-12-22(19)29-24-23/h3-6,8-9,11-12,28H,1-2,7,10,13-17H2 |
PubChem CID | 10430685 |
ChEMBL | CHEMBL160817 |
IUPHAR | N/A |
BindingDB | 50123697 |
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 |
---|---|---|---|---|---|
34811 | 5-hydroxytryptamine receptor 1A | P19327 | Htr1a | Rattus norvegicus (Rat) | 422 |
34816 | 5-hydroxytryptamine receptor 2A | P14842 | Htr2a | Rattus norvegicus (Rat) | 471 |
34815 | 5-hydroxytryptamine receptor 7 | P34969 | HTR7 | Homo sapiens (Human) | 479 |
34817 | 5-hydroxytryptamine receptor 7 | P32305 | Htr7 | Rattus norvegicus (Rat) | 448 |
34814 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
34813 | D(3) dopamine receptor | P19020 | Drd3 | Rattus norvegicus (Rat) | 446 |
34812 | D(4) dopamine receptor | P21917 | DRD4 | Homo sapiens (Human) | 467 |
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