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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	BRN 0563047
Molecular formula	C17H19N3O2
IUPAC name	1-(1,3-benzodioxol-5-ylmethyl)-4-pyridin-2-ylpiperazine
Molecular weight	297.358
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	2.4
Synonyms	AC1L2PUX LS-112860 SR-01000201430-1 Cambridge id 5257797 Oprea1_410752 1-(1,3-benzodioxol-5-ylmethyl)-4-pyridin-2-ylpiperazine 59215-20-2 CTK8D7321 SMR000476326 AC1Q6ZYD MLS001180858 1-(1,3-benzodioxol-5-ylmethyl)-4-(2-pyridinyl)piperazine Piperazine, 1-(3,4-methylenedioxybenzyl)-4-(2-pyridyl)- 1-(3,4-Methylenedioxybenzyl)-4-(2-pyridyl)piperazine AB00077026-01 HMS2788M22 SR-01000201430 MolPort-002-112-341 1-(1,3-benzodioxol-5-ylmethyl)-4-(pyridin-2-yl)piperazine CHEMBL1723874 SCHEMBL8879725 5-23-03-00045 (Beilstein Handbook Reference) [ Show all ]
Inchi Key	CEGRWSXQLTVGKZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H19N3O2/c1-2-6-18-17(3-1)20-9-7-19(8-10-20)12-14-4-5-15-16(11-14)22-13-21-15/h1-6,11H,7-10,12-13H2
PubChem CID	100984
ChEMBL	CHEMBL1723874
IUPHAR	N/A
BindingDB	N/A
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
39882	5-hydroxytryptamine receptor 2A	P35363	Htr2a	Mus musculus (Mouse)	471
39881	Mu-type opioid receptor	P35372	OPRM1	Homo sapiens (Human)	400

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