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Name | Yohimbine |
---|---|
Molecular formula | C21H26N2O3 |
IUPAC name | methyl (1S,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate |
Molecular weight | 354.45 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 2.9 |
Synonyms | MRF-0000020 APHRODINE Prestwick0_000584 Benz[g]indolo[2,3-a]quinolizine, yohimban-16-carboxylic acid deriv. SMP1_000320 [ Show all ] |
Inchi Key | BLGXFZZNTVWLAY-SCYLSFHTSA-N |
Inchi ID | InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1 |
PubChem CID | 8969 |
ChEMBL | CHEMBL15245 |
IUPHAR | 102 |
BindingDB | 50013515, 50203564 |
DrugBank | DB01392 |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
26585 | 5-hydroxytryptamine receptor 1A | P19327 | Htr1a | Rattus norvegicus (Rat) | 422 |
26596 | 5-hydroxytryptamine receptor 1A | P08908 | HTR1A | Homo sapiens (Human) | 422 |
26579 | 5-hydroxytryptamine receptor 1B | P28222 | HTR1B | Homo sapiens (Human) | 390 |
26593 | 5-hydroxytryptamine receptor 1B | P28564 | Htr1b | Rattus norvegicus (Rat) | 386 |
26595 | 5-hydroxytryptamine receptor 1B | P28334 | Htr1b | Mus musculus (Mouse) | 386 |
26618 | 5-hydroxytryptamine receptor 1B | O08892 | HTR1B | Cavia porcellus (Guinea pig) | 389 |
26575 | 5-hydroxytryptamine receptor 1D | P28221 | HTR1D | Homo sapiens (Human) | 377 |
26600 | 5-hydroxytryptamine receptor 1D | P28565 | Htr1d | Rattus norvegicus (Rat) | 374 |
26606 | 5-hydroxytryptamine receptor 1D | P11614 | HTR1D | Canis lupus familiaris (Dog) | 377 |
26583 | 5-hydroxytryptamine receptor 1E | P28566 | HTR1E | Homo sapiens (Human) | 365 |
26576 | 5-hydroxytryptamine receptor 1F | P30940 | Htr1f | Rattus norvegicus (Rat) | 366 |
26609 | 5-hydroxytryptamine receptor 1F | P30939 | HTR1F | Homo sapiens (Human) | 366 |
26626 | 5-hydroxytryptamine receptor 1F | Q02284 | Htr1f | Mus musculus (Mouse) | 366 |
26574 | 5-hydroxytryptamine receptor 2A | P28223 | HTR2A | Homo sapiens (Human) | 471 |
26602 | 5-hydroxytryptamine receptor 2A | P14842 | Htr2a | Rattus norvegicus (Rat) | 471 |
26572 | 5-hydroxytryptamine receptor 2B | P30994 | Htr2b | Rattus norvegicus (Rat) | 479 |
26584 | 5-hydroxytryptamine receptor 2B | P41595 | HTR2B | Homo sapiens (Human) | 481 |
26580 | 5-hydroxytryptamine receptor 2C | P08909 | Htr2c | Rattus norvegicus (Rat) | 460 |
26591 | 5-hydroxytryptamine receptor 2C | P28335 | HTR2C | Homo sapiens (Human) | 458 |
26605 | 5-hydroxytryptamine receptor 2C | P34968 | Htr2c | Mus musculus (Mouse) | 459 |
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