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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	(S)-Methylenedioxymethamphetamine
Molecular formula	C11H15NO2
IUPAC name	(2S)-1-(1,3-benzodioxol-5-yl)-N-methylpropan-2-amine
Molecular weight	193.246
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	2.2
Synonyms	(S)-N-BoC-Isoleucinenitrile ZINC859 (S)-(+)-3,4-(Methylenedioxy)methamphetamine PDSP1_001409 B41 UNII-KE1SEN21RM component SHXWCVYOXRDMCX-MRVPVSSYSA-N 142M890 CHEMBL195390 (S)-3,4-Methylenedioxymethamphetamine AC1LGYSL PDSP2_001393 (S)-N,alpha-Dimethyl-1,3-benzodioxole-5-ethanamine BDBM85332 UNII-KE1SEN21RM component SHXWCVYOXRDMCX-QMMMGPOBSA-N (2S)-1-(1,3-benzodioxol-5-yl)-N-methylpropan-2-amine 66142-89-0 MDMA, R(-) (S)-MDMA AKOS006293116 SCHEMBL15162286 [ Show all ]
Inchi Key	SHXWCVYOXRDMCX-QMMMGPOBSA-N
Inchi ID	InChI=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/t8-/m0/s1
PubChem CID	854031
ChEMBL	CHEMBL195390
IUPHAR	N/A
BindingDB	85332
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
314768	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
556728	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
314767	5-hydroxytryptamine receptor 2B	P41595	HTR2B	Homo sapiens (Human)	481
314766	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
556729	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
314764	Trace amine-associated receptor 1	Q8HZ64	TAAR1	Macaca mulatta (Rhesus macaque)	338
314765	Trace amine-associated receptor 1	Q96RJ0	TAAR1	Homo sapiens (Human)	339

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