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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	CHEMBL288450
Molecular formula	C23H26N4O2S
IUPAC name	2-[2-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethoxy]ethyl]-3H-isoindol-1-one
Molecular weight	422.547
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	3.2
Synonyms	BDBM50048809 SCHEMBL9378095 2-{2-[2-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-ethoxy]-ethyl}-2,3-dihydro-isoindol-1-one 2-[5-[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl]-3-oxapentan-1-yl]isoindolin-1-one
Inchi Key	ABANXTFMSGCHMG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H26N4O2S/c28-23-19-6-2-1-5-18(19)17-27(23)14-16-29-15-13-25-9-11-26(12-10-25)22-20-7-3-4-8-21(20)30-24-22/h1-8H,9-17H2
PubChem CID	10764716
ChEMBL	CHEMBL288450
IUPHAR	N/A
BindingDB	50048809
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
709	5-hydroxytryptamine receptor 1A	P19327	Htr1a	Rattus norvegicus (Rat)	422
710	D(2) dopamine receptor	P61169	Drd2	Rattus norvegicus (Rat)	444

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