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Ligand

Name139290-69-0
Molecular formulaC22H28FNO3
IUPAC name(2,3-dimethoxyphenyl)-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol
Molecular weight373.468
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.9
Synonyms4-Piperidinemethanol, alpha-(2,3-dimethoxyphenyl)-1-(2-(4-fluorophenyl)ethyl)-, (+)-
alpha-(2,3-dimethoxyphenyl)-1-[2-(4-fluorophenyl)ethyl]4-piperidine methanol
HXTGXYRHXAGCFP-UHFFFAOYSA-N
MolPort-039-331-873
(1-(4-fluorophenethyl)piperidin-4-yl)(2,3-dimethoxyphenyl)methanol
[ Show all ]
Inchi KeyHXTGXYRHXAGCFP-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H28FNO3/c1-26-20-5-3-4-19(22(20)27-2)21(25)17-11-14-24(15-12-17)13-10-16-6-8-18(23)9-7-16/h3-9,17,21,25H,10-15H2,1-2H3
PubChem CID60858
ChEMBLN/A
IUPHARN/A
BindingDB50232153
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 36
Page:  / 2 

GLASS IDNameUniProtGeneSpeciesLength
1266755-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
1266665-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
1266715-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
1266575-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
5559845-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
1266655-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
1266565-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
1266615-hydroxytryptamine receptor 2CP08909Htr2cRattus norvegicus (Rat)460
1266535-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
1266485-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
126649Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
126678Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
126660Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
126667Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
126654Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
126664Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
126677Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
460382Beta-2 adrenergic receptorP10608Adrb2Rattus norvegicus (Rat)418
126668D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
126655D(1B) dopamine receptorP21918DRD5Homo sapiens (Human)477

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