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Name | CHEMBL294730 |
---|---|
Molecular formula | C22H27N3O2S |
IUPAC name | 6-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-1,3-benzothiazol-2-one |
Molecular weight | 397.537 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 4.1 |
Synonyms | 6-{3-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-propyl}-3-methyl-3H-benzothiazol-2-one 3-Methyl-6-[3-[4-(2-methoxyphenyl)piperazino]propyl]benzothiazole-2(3H)-one BDBM50064583 SCHEMBL7761659 |
Inchi Key | HQRJJQDPSVJHQO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H27N3O2S/c1-23-19-10-9-17(16-21(19)28-22(23)26)6-5-11-24-12-14-25(15-13-24)18-7-3-4-8-20(18)27-2/h3-4,7-10,16H,5-6,11-15H2,1-2H3 |
PubChem CID | 10644514 |
ChEMBL | CHEMBL294730 |
IUPHAR | N/A |
BindingDB | 50064583 |
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 |
---|---|---|---|---|---|
121667 | 5-hydroxytryptamine receptor 1A | P08908 | HTR1A | Homo sapiens (Human) | 422 |
121670 | 5-hydroxytryptamine receptor 1B | P28564 | Htr1b | Rattus norvegicus (Rat) | 386 |
121671 | 5-hydroxytryptamine receptor 2A | Q75Z89 | HTR2A | Bos taurus (Bovine) | 470 |
121669 | 5-hydroxytryptamine receptor 2C | P28335 | HTR2C | Homo sapiens (Human) | 458 |
121672 | Alpha-1A adrenergic receptor | P18130 | ADRA1A | Bos taurus (Bovine) | 466 |
121668 | D(2) dopamine receptor | P20288 | DRD2 | Bos taurus (Bovine) | 444 |
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