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Ligand

Nameterguride
Molecular formulaC20H28N4O
IUPAC name3-[(6aR,9S,10aR)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]-1,1-diethylurea
Molecular weight340.471
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP2.5
SynonymsD01348
FT-0667042
N,N-Dethyl-n'-[(8alpha)-6-methylergoln-8-yl]urea
Prestwick1_000945
SCHEMBL147259
[ Show all ]
Inchi KeyJOAHPSVPXZTVEP-YXJHDRRASA-N
Inchi IDInChI=1S/C20H28N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,11,14,16,18,21H,4-5,9-10,12H2,1-3H3,(H,22,25)/t14-,16+,18+/m0/s1
PubChem CID443951
ChEMBLCHEMBL73151
IUPHAR56
BindingDB50017519
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: 27
Page:  / 2 

GLASS IDNameUniProtGeneSpeciesLength
1556845-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
1556855-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
1556735-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
1556745-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
1556755-hydroxytryptamine receptor 2AP35363Htr2aMus musculus (Mouse)471
1556775-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
1556655-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
1556725-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
5560665-hydroxytryptamine receptor 7P50407HTR7Cavia porcellus (Guinea pig)446
554050Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
155668Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
155663Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572
155661Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
155669Alpha-2A adrenergic receptorP22909Adra2aRattus norvegicus (Rat)450
155679Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
155666Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
155671Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
556065Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
155676D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
155681D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446

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