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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	CHEMBL323454
Molecular formula	C27H35BrN2O2
IUPAC name	[4-[4-[(4-bromophenyl)-hydroxymethyl]piperidin-1-yl]-4-methylpiperidin-1-yl]-(2,6-dimethylphenyl)methanone
Molecular weight	499.493
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	5.2
Synonyms	1,4'-Bipiperidine, 4-[(4-bromophenyl)hydroxymethyl]-1'-(2,6-dimethylbenzoyl)-4'-methyl- {4-[(4-Bromo-phenyl)-hydroxy-methyl]-4''-methyl-[1,4'']bipiperidinyl-1''-yl}-(2,6-dimethyl-phenyl)-methanone BDBM50115524 [4-[4-[(4-bromophenyl)-hydroxy-methyl]-1-piperidyl]-4-methyl-1-piperidyl]-(2,6-dimethylphenyl)methanone [4-[4-[(4-bromophenyl)-hydroxymethyl]piperidin-1-yl]-4-methylpiperidin-1-yl]-(2,6-dimethylphenyl)methanone AC1LACIA [ Show all ]
Inchi Key	IYUGABYSRYTCQT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H35BrN2O2/c1-19-5-4-6-20(2)24(19)26(32)29-17-13-27(3,14-18-29)30-15-11-22(12-16-30)25(31)21-7-9-23(28)10-8-21/h4-10,22,25,31H,11-18H2,1-3H3
PubChem CID	511298
ChEMBL	CHEMBL323454
IUPHAR	N/A
BindingDB	50115524
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
145016	C-C chemokine receptor type 5	P51682	Ccr5	Mus musculus (Mouse)	354
145017	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352

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