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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	SCHEMBL9999166
Molecular formula	C26H31F3N6O2S
IUPAC name	N-[1-[4-hydroxy-4-(1,3-thiazol-5-yl)cyclohexyl]azetidin-3-yl]-2-[[2-propan-2-yl-6-(trifluoromethyl)quinazolin-4-yl]amino]acetamide
Molecular weight	548.629
Hydrogen bond acceptor	11
Hydrogen bond donor	3
XlogP	4.1
Synonyms	SCHEMBL12052971 SCHEMBL9999167 SCHEMBL15214621 US9062048, 88 CHEMBL3906803 BDBM163459 [ Show all ]
Inchi Key	FRIUIPFFUUXNHO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H31F3N6O2S/c1-15(2)23-33-20-4-3-16(26(27,28)29)9-19(20)24(34-23)31-11-22(36)32-17-12-35(13-17)18-5-7-25(37,8-6-18)21-10-30-14-38-21/h3-4,9-10,14-15,17-18,37H,5-8,11-13H2,1-2H3,(H,32,36)(H,31,33,34)
PubChem CID	54768837
ChEMBL	CHEMBL3906803
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons.

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
538106	C-C chemokine receptor-like 2	O00421	CCRL2	Homo sapiens (Human)	344

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