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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	CHEMBL246943
Molecular formula	C22H25ClN2O5S
IUPAC name	3-[[4-[4-[1-(2-chlorocyclohexen-1-yl)ethoxycarbonylamino]-1,2-oxazol-3-yl]phenyl]methylsulfanyl]propanoic acid
Molecular weight	464.961
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	3.7
Synonyms	BDBM50211647 SCHEMBL4024814 3-(4-(4-((1-(2-chlorocyclohex-1-enyl)ethoxy)carbonyl)isoxazol-3-yl)benzylthio)propanoic acid
Inchi Key	RXDYETAEWGWCSO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H25ClN2O5S/c1-14(17-4-2-3-5-18(17)23)30-22(28)24-19-12-29-25-21(19)16-8-6-15(7-9-16)13-31-11-10-20(26)27/h6-9,12,14H,2-5,10-11,13H2,1H3,(H,24,28)(H,26,27)
PubChem CID	11305821
ChEMBL	CHEMBL246943
IUPHAR	N/A
BindingDB	50211647
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
307296	Lysophosphatidic acid receptor 1	P61794	Lpar1	Rattus norvegicus (Rat)	364
307297	Lysophosphatidic acid receptor 1	Q92633	LPAR1	Homo sapiens (Human)	364

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