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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	3-{[4-(pyrimidin-2-yl)piperazin-1-yl]methyl}-1h-indole
Molecular formula	C17H19N5
IUPAC name	3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1H-indole
Molecular weight	293.374
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.0
Synonyms	IFLab1_004430 Oprea1_826947 3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1H-indole GKKBEFXMNBECNL-UHFFFAOYSA-N MolPort-000-739-026 SR-01000010007 AC1L8GPQ HMS3312F14 NSC713724 ZINC59857731 CHEMBL1597217 MCULE-5228574574 Piperazine, 1-(3-indolylmethyl)-4-(2-pyrimidyl)- HMS1424J08 NCI60_039564 SR-01000010007-1 AKOS022095992 IDI1_010185 Oprea1_412143 3-([4-(2-Pyrimidinyl)-1-piperazinyl]methyl)-1H-indole # CTK5J7493 MLS000038534 SMR000037937 371137-40-5 HMS2157J24 NSC-713724 STL332686 [ Show all ]
Inchi Key	GKKBEFXMNBECNL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H19N5/c1-2-5-16-15(4-1)14(12-20-16)13-21-8-10-22(11-9-21)17-18-6-3-7-19-17/h1-7,12,20H,8-11,13H2
PubChem CID	401019
ChEMBL	CHEMBL1597217
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
98743	5-hydroxytryptamine receptor 2A	P35363	Htr2a	Mus musculus (Mouse)	471
98742	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
98740	Mu-type opioid receptor	P35372	OPRM1	Homo sapiens (Human)	400
98741	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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