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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	CHEMBL110871
Molecular formula	C28H37BrN2O
IUPAC name	[4-[4-[1-(4-bromophenyl)ethyl]piperidin-1-yl]-4-methylpiperidin-1-yl]-(2,6-dimethylphenyl)methanone
Molecular weight	497.521
Hydrogen bond acceptor	2
Hydrogen bond donor	0
XlogP	6.6
Synonyms	[4-[4-[1-(4-bromophenyl)ethyl]piperidin-1-yl]-4-methylpiperidin-1-yl]-(2,6-dimethylphenyl)methanone AC1LACID 1,4'-Bipiperidine, 4-[1-(4-bromophenyl)ethyl]-1'-(2,6-dimethylbenzoyl)-4'-methyl- {4-[1-(4-Bromo-phenyl)-ethyl]-4''-methyl-[1,4'']bipiperidinyl-1''-yl}-(2,6-dimethyl-phenyl)-methanone BDBM50115541 [4-[4-[1-(4-bromophenyl)ethyl]-1-piperidyl]-4-methyl-1-piperidyl]-(2,6-dimethylphenyl)methanone [ Show all ]
Inchi Key	UHYXGTUWXYIOFH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H37BrN2O/c1-20-6-5-7-21(2)26(20)27(32)30-18-14-28(4,15-19-30)31-16-12-24(13-17-31)22(3)23-8-10-25(29)11-9-23/h5-11,22,24H,12-19H2,1-4H3
PubChem CID	511299
ChEMBL	CHEMBL110871
IUPHAR	N/A
BindingDB	50115541
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

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
337224	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352
337225	C-C chemokine receptor type 5	P51682	Ccr5	Mus musculus (Mouse)	354

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