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Ligand

NameRS-100235
Molecular formulaC27H35ClN2O5
IUPAC name1-(5-amino-6-chloro-2,3-dihydro-1,4-benzodioxin-8-yl)-3-[1-[3-(3,4-dimethoxyphenyl)propyl]piperidin-4-yl]propan-1-one
Molecular weight503.036
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.6
SynonymsRS100235
RS 100235
1-(5-amino-6-chloro-2,3-dihydro-1,4-benzodioxin-8-yl)-3-[1-[3-(3,4-dimethoxyphenyl)propyl]piperidin-4-yl]propan-1-one
PDSP1_001701
AC1NSKL6
[ Show all ]
Inchi KeyUVOCSZKGWJOKNN-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H35ClN2O5/c1-32-23-8-6-19(16-24(23)33-2)4-3-11-30-12-9-18(10-13-30)5-7-22(31)20-17-21(28)25(29)27-26(20)34-14-15-35-27/h6,8,16-18H,3-5,7,9-15,29H2,1-2H3
PubChem CID5311416
ChEMBLCHEMBL69733
IUPHAR250
BindingDB85027
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 17
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3467235-hydroxytryptamine receptor 1AQ64264Htr1aMus musculus (Mouse)421
3467155-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
3467115-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
3467135-hydroxytryptamine receptor 4O70528HTR4Cavia porcellus (Guinea pig)388
3467185-hydroxytryptamine receptor 4Q62758Htr4Rattus norvegicus (Rat)406
5550095-hydroxytryptamine receptor 4Q13639HTR4Homo sapiens (Human)388
346712Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
346720Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
346708Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
346722Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
346709D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
346721D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
346717Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
346714Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
346710Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590
346707Type-1 angiotensin II receptorP30556AGTR1Homo sapiens (Human)359
346719Type-2 angiotensin II receptorP50052AGTR2Homo sapiens (Human)363

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