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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	SCHEMBL2512772
Molecular formula	C18H26ClF3N6O2S
IUPAC name	4-[(2R)-4-tert-butylpiperazine-2-carbonyl]-N-[5-chloro-4-(trifluoromethyl)-1,3-thiazol-2-yl]piperazine-1-carboxamide
Molecular weight	482.951
Hydrogen bond acceptor	9
Hydrogen bond donor	2
XlogP	2.1
Synonyms	BVIJCXFDGHSEMW-LLVKDONJSA-N 4-[(2R)-4-tert-butylpiperazine-2-carbonyl]-N-[5-chloro-4-(trifluoromethyl)-1,3-thiazol-2-yl]piperazine-1-carboxamide CHEMBL3770912
Inchi Key	BVIJCXFDGHSEMW-LLVKDONJSA-N
Inchi ID	InChI=1S/C18H26ClF3N6O2S/c1-17(2,3)28-5-4-23-11(10-28)14(29)26-6-8-27(9-7-26)16(30)25-15-24-12(13(19)31-15)18(20,21)22/h11,23H,4-10H2,1-3H3,(H,24,25,30)/t11-/m1/s1
PubChem CID	86642531
ChEMBL	CHEMBL3770912
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
522560	C-C chemokine receptor type 2	P41597	CCR2	Homo sapiens (Human)	374
522561	C-C chemokine receptor type 2	O55193	Ccr2	Rattus norvegicus (Rat)	373

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