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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	CHEMBL391256
Molecular formula	C24H29N3O2
IUPAC name	3-ethynyl-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]benzamide
Molecular weight	391.515
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	3.8
Synonyms	N-{4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl}-3-ethynylbenzamide BDBM50221672
Inchi Key	CQBTYAKAEVDTHI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H29N3O2/c1-3-20-9-8-10-21(19-20)24(28)25-13-6-7-14-26-15-17-27(18-16-26)22-11-4-5-12-23(22)29-2/h1,4-5,8-12,19H,6-7,13-18H2,2H3,(H,25,28)
PubChem CID	44436602
ChEMBL	CHEMBL391256
IUPHAR	N/A
BindingDB	50221672
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
47911	5-hydroxytryptamine receptor 2A	P50129	HTR2A	Sus scrofa (Pig)	470
47912	D(1A) dopamine receptor	P50130	DRD1	Sus scrofa (Pig)	446
47914	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
47913	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
522931	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467

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