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Name | CHEMBL293879 |
---|---|
Molecular formula | C17H20N4O2S |
IUPAC name | ethyl 2-[4-(3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaen-8-yl)piperazin-1-yl]acetate |
Molecular weight | 344.433 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 3.4 |
Synonyms | BDBM50407766 |
Inchi Key | PQWUNHKJEXFYJI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H20N4O2S/c1-2-23-15(22)12-19-7-9-20(10-8-19)16-14-4-3-6-21(14)17-13(18-16)5-11-24-17/h3-6,11H,2,7-10,12H2,1H3 |
PubChem CID | 10569470 |
ChEMBL | CHEMBL293879 |
IUPHAR | N/A |
BindingDB | 50407766 |
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 |
---|---|---|---|---|---|
266577 | 5-hydroxytryptamine receptor 1A | P08908 | HTR1A | Homo sapiens (Human) | 422 |
266579 | 5-hydroxytryptamine receptor 1B | P28564 | Htr1b | Rattus norvegicus (Rat) | 386 |
266581 | 5-hydroxytryptamine receptor 1D | P79400 | HTR1D | Sus scrofa (Pig) | 291 |
266580 | 5-hydroxytryptamine receptor 2A | Q75Z89 | HTR2A | Bos taurus (Bovine) | 470 |
266578 | 5-hydroxytryptamine receptor 2C | P28335 | HTR2C | Homo sapiens (Human) | 458 |
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