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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	CHEMBL187888
Molecular formula	C13H15N3
IUPAC name	(4R,10aR)-4-methyl-1,2,3,4,10,10a-hexahydropyrazino[1,2-a]indole-7-carbonitrile
Molecular weight	213.284
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	1.6
Synonyms	(4R,10aR)-4-Methyl-1,2,3,4,10,10a-hexahydro-pyrazino[1,2-a]indole-7-carbonitrile BDBM50169258 SCHEMBL5356309
Inchi Key	AAELFMMXNFMCCW-BXKDBHETSA-N
Inchi ID	InChI=1S/C13H15N3/c1-9-7-15-8-12-5-11-3-2-10(6-14)4-13(11)16(9)12/h2-4,9,12,15H,5,7-8H2,1H3/t9-,12-/m1/s1
PubChem CID	44397731
ChEMBL	CHEMBL187888
IUPHAR	N/A
BindingDB	50169258
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
142	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
141	5-hydroxytryptamine receptor 2B	P41595	HTR2B	Homo sapiens (Human)	481
143	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458

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