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Name | CHEMBL3986651 |
---|---|
Molecular formula | C22H28N2O3 |
IUPAC name | (2S)-4-[2-(2,3-dihydroindol-1-yl)ethyl]-2-[(3-methoxyphenoxy)methyl]morpholine |
Molecular weight | 368.477 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 3.4 |
Synonyms | BDBM186937 ROKNCKQMECSPFV-NRFANRHFSA-N (S)-4-(2-(Indolin-1-yl)ethyl)-2-((3-methoxyphenoxy)methyl)morpholine SCHEMBL14061752 US9079895, 25s |
Inchi Key | ROKNCKQMECSPFV-NRFANRHFSA-N |
Inchi ID | InChI=1S/C22H28N2O3/c1-25-19-6-4-7-20(15-19)27-17-21-16-23(13-14-26-21)11-12-24-10-9-18-5-2-3-8-22(18)24/h2-8,15,21H,9-14,16-17H2,1H3/t21-/m0/s1 |
PubChem CID | 71062708 |
ChEMBL | CHEMBL3986651 |
IUPHAR | N/A |
BindingDB | 186937 |
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 |
---|---|---|---|---|---|
544114 | 5-hydroxytryptamine receptor 1A | Q64264 | Htr1a | Mus musculus (Mouse) | 421 |
544112 | 5-hydroxytryptamine receptor 1D | Q61224 | Htr1d | Mus musculus (Mouse) | 374 |
544109 | 5-hydroxytryptamine receptor 2A | P35363 | Htr2a | Mus musculus (Mouse) | 471 |
544108 | 5-hydroxytryptamine receptor 2B | Q02152 | Htr2b | Mus musculus (Mouse) | 479 |
544117 | 5-hydroxytryptamine receptor 2C | P34968 | Htr2c | Mus musculus (Mouse) | 459 |
544107 | Alpha-1A adrenergic receptor | P97718 | Adra1a | Mus musculus (Mouse) | 466 |
544116 | Alpha-1D adrenergic receptor | P97714 | Adra1d | Mus musculus (Mouse) | 562 |
544115 | D(1A) dopamine receptor | Q61616 | Drd1 | Mus musculus (Mouse) | 446 |
544110 | D(1B) dopamine receptor | Q8BLD9 | Drd5 | Mus musculus (Mouse) | 478 |
544118 | D(2) dopamine receptor | P61168 | Drd2 | Mus musculus (Mouse) | 444 |
544113 | D(3) dopamine receptor | P30728 | Drd3 | Mus musculus (Mouse) | 446 |
544111 | D(4) dopamine receptor | P51436 | Drd4 | Mus musculus (Mouse) | 387 |
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