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Name | raloxifene |
---|---|
Molecular formula | C28H27NO4S |
IUPAC name | [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone |
Molecular weight | 473.587 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 6.1 |
Synonyms | LY-156758 NCGC00015889-02 6-hydroxy-2-(4-hydroxyphenyl)-3-[4-(2-piperidinoethoxy)benzoyl]benzo[b]-thiophene NCGC00092353-04 82640-04-8 (hydrochloride) [ Show all ] |
Inchi Key | GZUITABIAKMVPG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C28H27NO4S/c30-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-29-14-2-1-3-15-29/h4-13,18,30-31H,1-3,14-17H2 |
PubChem CID | 5035 |
ChEMBL | CHEMBL81 |
IUPHAR | 2820 |
BindingDB | 19441 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
109454 | 5-hydroxytryptamine receptor 1B | P28564 | Htr1b | Rattus norvegicus (Rat) | 386 |
109455 | 5-hydroxytryptamine receptor 2A | P28223 | HTR2A | Homo sapiens (Human) | 471 |
109474 | 5-hydroxytryptamine receptor 2B | P41595 | HTR2B | Homo sapiens (Human) | 481 |
109458 | 5-hydroxytryptamine receptor 2C | P28335 | HTR2C | Homo sapiens (Human) | 458 |
109465 | 5-hydroxytryptamine receptor 6 | P50406 | HTR6 | Homo sapiens (Human) | 440 |
109469 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
446012 | Alpha-1A adrenergic receptor | P43140 | Adra1a | Rattus norvegicus (Rat) | 466 |
109468 | Alpha-1B adrenergic receptor | P15823 | Adra1b | Rattus norvegicus (Rat) | 515 |
109461 | Alpha-1D adrenergic receptor | P25100 | ADRA1D | Homo sapiens (Human) | 572 |
109457 | Alpha-2A adrenergic receptor | P08913 | ADRA2A | Homo sapiens (Human) | 450 |
109459 | Alpha-2B adrenergic receptor | P18089 | ADRA2B | Homo sapiens (Human) | 450 |
109464 | Alpha-2C adrenergic receptor | P18825 | ADRA2C | Homo sapiens (Human) | 462 |
109467 | D(1A) dopamine receptor | P21728 | DRD1 | Homo sapiens (Human) | 446 |
109456 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
109470 | D(3) dopamine receptor | P35462 | DRD3 | Homo sapiens (Human) | 400 |
109462 | Delta-type opioid receptor | P41143 | OPRD1 | Homo sapiens (Human) | 372 |
553795 | G-protein coupled estrogen receptor 1 | Q99527 | GPER1 | Homo sapiens (Human) | 375 |
109471 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
109460 | Mu-type opioid receptor | P35372 | OPRM1 | Homo sapiens (Human) | 400 |
109466 | Muscarinic acetylcholine receptor M1 | P08482 | Chrm1 | Rattus norvegicus (Rat) | 460 |
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