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Ligand

NameMELPERONE
Molecular formulaC16H22FNO
IUPAC name1-(4-fluorophenyl)-4-(4-methylpiperidin-1-yl)butan-1-one
Molecular weight263.356
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP3.3
Synonyms4-Fluoro-|A-(4-methylpiperidino)butyrophenone
BRD-K92984783-003-02-4
CHEMBL1531134
DSSTox_RID_76964
L000772
[ Show all ]
Inchi KeyDKMFBWQBDIGMHM-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H22FNO/c1-13-8-11-18(12-9-13)10-2-3-16(19)14-4-6-15(17)7-5-14/h4-7,13H,2-3,8-12H2,1H3
PubChem CID15387
ChEMBLN/A
IUPHARN/A
BindingDB81771
DrugBankDB09224

Structure

SDF download

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

Known GPCRs

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Total entries: 21
Page:  / 2 

GLASS IDNameUniProtGeneSpeciesLength
624105-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
624195-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
624085-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
5557185-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
624115-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
624165-hydroxytryptamine receptor 2CP08909Htr2cRattus norvegicus (Rat)460
624045-hydroxytryptamine receptor 6P31388Htr6Rattus norvegicus (Rat)436
5557205-hydroxytryptamine receptor 7P32305Htr7Rattus norvegicus (Rat)448
555719Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
62412Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
62407D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
555717D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
62406D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
62405D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467
62414D(4) dopamine receptorP30729Drd4Rattus norvegicus (Rat)387
62415Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
62413Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
62417Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
62409Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590
62418Muscarinic acetylcholine receptor M4P08173CHRM4Homo sapiens (Human)479

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