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Name | Setoperone |
---|---|
Molecular formula | C21H24FN3O2S |
IUPAC name | 6-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-7-methyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
Molecular weight | 401.5 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 2.8 |
Synonyms | 5H-Thiazolo[3,2a]pyrimidin-5-one, 6-[2-[4-(4-fluorobenzoyl)-1-piperidinyl]ethyl]-2,3-dihydro-7-methyl- 86487-64-1 CAS-86487-64-1 DTXSID9057848 PDSP2_001208 [ Show all ] |
Inchi Key | RBGAHDDQSRBDOG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H24FN3O2S/c1-14-18(20(27)25-12-13-28-21(25)23-14)8-11-24-9-6-16(7-10-24)19(26)15-2-4-17(22)5-3-15/h2-5,16H,6-13H2,1H3 |
PubChem CID | 68604 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 81814 |
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 |
---|---|---|---|---|---|
292026 | Alpha-1A adrenergic receptor | P43140 | Adra1a | Rattus norvegicus (Rat) | 466 |
292025 | Alpha-2A adrenergic receptor | P08913 | ADRA2A | Homo sapiens (Human) | 450 |
292024 | Alpha-2B adrenergic receptor | P19328 | Adra2b | Rattus norvegicus (Rat) | 453 |
292023 | Alpha-2C adrenergic receptor | P22086 | Adra2c | Rattus norvegicus (Rat) | 458 |
556615 | D(3) dopamine receptor | P19020 | Drd3 | Rattus norvegicus (Rat) | 446 |
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