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Ligand

NameMDMA
Molecular formulaC11H15NO2
IUPAC name1-(1,3-benzodioxol-5-yl)-N-methylpropan-2-amine
Molecular weight193.246
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.2
SynonymsN-METHYL-3,4-METHYLENEDIOXYAMPHETAMINE
rac-MDMA (rac-3,4-Methylenedioxymethamphetamine) 1.0 mg/ml in Methanol
(+/-)-3,4-METHYLENEDIOXYMETHAMPHETAMINE
3,4-MDMA
64057-70-1 (hydrochloride)
[ Show all ]
Inchi KeySHXWCVYOXRDMCX-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H15NO2/c1-8(12-2)5-9-3-4-10-11(6-9)14-7-13-10/h3-4,6,8,12H,5,7H2,1-2H3
PubChem CID1615
ChEMBLCHEMBL43048
IUPHARN/A
BindingDB50010588
DrugBankDB01454

Structure

SDF download

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

Known GPCRs

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Total entries: 44
Page:  / 3 

GLASS IDNameUniProtGeneSpeciesLength
3147805-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
3148035-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
3147925-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
3147765-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
3147875-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
5567335-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
3147755-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
3147795-hydroxytryptamine receptor 2CP08909Htr2cRattus norvegicus (Rat)460
3148055-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
3148045-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
3147745-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
3147975-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
314773Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
314769Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
314782Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
314789Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
314781Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
314791Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
314793Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466
314800Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413

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