You can:
| Name | CHEMBL2261429 |
|---|---|
| Molecular formula | C22H27N3O4 |
| IUPAC name | 4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione |
| Molecular weight | 397.475 |
| Hydrogen bond acceptor | 6 |
| Hydrogen bond donor | 1 |
| XlogP | 1.3 |
| Synonyms | 4-[2-hydroxy-3-(4-phenyl-piperazin-1-yl)-propoxy]-4-aza-tricyclo[5.2.1.02,6]dec-8-ene-3,5-dione BDBM93102 4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-4-azatricyclo[5.2.1.0^{2,6}]dec-8-ene-3,5-dione, 3 |
| Inchi Key | GHDNAOMLMMZWQC-UHFFFAOYSA-N |
| Inchi ID | InChI=1S/C22H27N3O4/c26-18(13-23-8-10-24(11-9-23)17-4-2-1-3-5-17)14-29-25-21(27)19-15-6-7-16(12-15)20(19)22(25)28/h1-7,15-16,18-20,26H,8-14H2 |
| PubChem CID | 25032872 |
| ChEMBL | CHEMBL2261429 |
| IUPHAR | N/A |
| BindingDB | 93102 |
| DrugBank | N/A |
Structure |  |
| Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
You can:
| GLASS ID | Name | UniProt | Gene | Species | Length |
|---|---|---|---|---|---|
| 96381 | 5-hydroxytryptamine receptor 1A | P19327 | Htr1a | Rattus norvegicus (Rat) | 422 |
| 96382 | 5-hydroxytryptamine receptor 2A | P14842 | Htr2a | Rattus norvegicus (Rat) | 471 |
| 96383 | Beta-1 adrenergic receptor | P18090 | Adrb1 | Rattus norvegicus (Rat) | 466 |
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