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Ligand

Nameondansetron
Molecular formulaC18H19N3O
IUPAC name9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-one
Molecular weight293.37
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP2.3
Synonyms99614-02-5
Zofran
Zophren
Zudan
Zofran ODT
[ Show all ]
Inchi KeyFELGMEQIXOGIFQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H19N3O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2/h3-6,9-10,13H,7-8,11H2,1-2H3
PubChem CID4595
ChEMBLCHEMBL46
IUPHARN/A
BindingDB85330
DrugBankDB00904

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 33
Page:  / 2 

GLASS IDNameUniProtGeneSpeciesLength
763625-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
763735-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
763485-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
763755-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
763635-hydroxytryptamine receptor 1DP28565Htr1dRattus norvegicus (Rat)374
763495-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
763645-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
763555-hydroxytryptamine receptor 2CP08909Htr2cRattus norvegicus (Rat)460
763595-hydroxytryptamine receptor 4O70528HTR4Cavia porcellus (Guinea pig)388
763615-hydroxytryptamine receptor 4Q62758Htr4Rattus norvegicus (Rat)406
763705-hydroxytryptamine receptor 4Q13639HTR4Homo sapiens (Human)388
763655-hydroxytryptamine receptor 5BP35365Htr5bRattus norvegicus (Rat)370
5557645-hydroxytryptamine receptor 7P32305Htr7Rattus norvegicus (Rat)448
76350Alpha-2A adrenergic receptorP22909Adra2aRattus norvegicus (Rat)450
76371Cholecystokinin receptor type AP30551CckarRattus norvegicus (Rat)444
76353D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
76367D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
76354D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
555765D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
76372D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446

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