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Name | SCHEMBL8097715 |
---|---|
Molecular formula | C25H27NO5 |
IUPAC name | 2-(2,6-dimethoxyphenoxy)-N-[(3-phenyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]ethanamine |
Molecular weight | 421.493 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.4 |
Synonyms | CAS_185453 L001148 BDBM81444 NSC_185453 |
Inchi Key | UVEKKXRFQCNLQE-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H27NO5/c1-27-21-13-8-14-22(28-2)25(21)29-16-15-26-17-23-24(18-9-4-3-5-10-18)31-20-12-7-6-11-19(20)30-23/h3-14,23-24,26H,15-17H2,1-2H3 |
PubChem CID | 14743454 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 81444 |
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 |
---|---|---|---|---|---|
346459 | 5-hydroxytryptamine receptor 1D | P28221 | HTR1D | Homo sapiens (Human) | 377 |
346458 | 5-hydroxytryptamine receptor 2A | P28223 | HTR2A | Homo sapiens (Human) | 471 |
346472 | 5-hydroxytryptamine receptor 2A | P50129 | HTR2A | Sus scrofa (Pig) | 470 |
556900 | 5-hydroxytryptamine receptor 7 | P32305 | Htr7 | Rattus norvegicus (Rat) | 448 |
346453 | Alpha-1A adrenergic receptor | P43140 | Adra1a | Rattus norvegicus (Rat) | 466 |
346457 | Alpha-1A adrenergic receptor | Q9WU25 | ADRA1A | Cavia porcellus (Guinea pig) | 466 |
346469 | Alpha-1A adrenergic receptor | P18130 | ADRA1A | Bos taurus (Bovine) | 466 |
556898 | Alpha-1A adrenergic receptor | P35348 | ADRA1A | Homo sapiens (Human) | 466 |
346471 | Alpha-1B adrenergic receptor | P18841 | ADRA1B | Mesocricetus auratus (Golden hamster) | 515 |
346473 | Alpha-1B adrenergic receptor | P15823 | Adra1b | Rattus norvegicus (Rat) | 515 |
346456 | Alpha-2A adrenergic receptor | P22909 | Adra2a | Rattus norvegicus (Rat) | 450 |
346463 | Alpha-2A adrenergic receptor | Q28838 | ADRA2A | Bos taurus (Bovine) | 452 |
346468 | Alpha-2A adrenergic receptor | P08913 | ADRA2A | Homo sapiens (Human) | 450 |
346474 | Alpha-2A adrenergic receptor | P18871 | ADRA2A | Sus scrofa (Pig) | 450 |
346455 | Alpha-2B adrenergic receptor | P18089 | ADRA2B | Homo sapiens (Human) | 450 |
346460 | Alpha-2B adrenergic receptor | P19328 | Adra2b | Rattus norvegicus (Rat) | 453 |
346464 | Alpha-2B adrenergic receptor | O77715 | ADRA2B | Didelphis virginiana (North American opossum) | 382 |
346467 | Alpha-2B adrenergic receptor | O77830 | ADRA2B | Oryctolagus cuniculus (Rabbit) | 394 |
346454 | Alpha-2C adrenergic receptor | P22086 | Adra2c | Rattus norvegicus (Rat) | 458 |
346462 | Alpha-2C adrenergic receptor | P18825 | ADRA2C | Homo sapiens (Human) | 462 |
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