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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	CHEMBL95235
Molecular formula	C20H31N5O2
IUPAC name	2-oxo-3-propan-2-yl-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]benzimidazole-1-carboxamide
Molecular weight	373.501
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.5
Synonyms	3-Isopropyl-2-oxo-2,3-dihydro-benzoimidazole-1-carboxylic acid [2-(4-isopropyl-piperazin-1-yl)-ethyl]-amide BDBM50079301 3-Isopropyl-N-[2-(4-isopropylpiperazino)ethyl]-2-oxo-2,3-dihydro-1H-benzimidazole-1-carboxamide
Inchi Key	DOJDIVHKNPSSHL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H31N5O2/c1-15(2)23-13-11-22(12-14-23)10-9-21-19(26)25-18-8-6-5-7-17(18)24(16(3)4)20(25)27/h5-8,15-16H,9-14H2,1-4H3,(H,21,26)
PubChem CID	10761898
ChEMBL	CHEMBL95235
IUPHAR	N/A
BindingDB	50079301
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
65020	5-hydroxytryptamine receptor 4	O70528	HTR4	Cavia porcellus (Guinea pig)	388

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