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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	CHEMBL106247
Molecular formula	C27H35BrN2O
IUPAC name	[4-[4-[(4-bromophenyl)methyl]piperidin-1-yl]-4-methylpiperidin-1-yl]-(2,6-dimethylphenyl)methanone
Molecular weight	483.494
Hydrogen bond acceptor	2
Hydrogen bond donor	0
XlogP	6.3
Synonyms	1,4'-Bipiperidine, 4-[(4-bromophenyl)methyl]-1'-(2,6-dimethylbenzoyl)-4'-methyl- [4-(4-Bromo-benzyl)-4''-methyl-[1,4'']bipiperidinyl-1''-yl]-(2,6-dimethyl-phenyl)-methanone 4-(4-Bromobenzyl)-4'-methyl-1'-(2,6-dimethylbenzoyl)-1,4'-bi(piperidine) [4-[4-[(4-bromophenyl)methyl]-1-piperidyl]-4-methyl-1-piperidyl]-(2,6-dimethylphenyl)methanone AC1L9XDY 4-[(4-Bromophenyl)methyl]-1''-(2,6-dimethylbenzoyl)-4''-methyl-1,4''-bipiperidine [4-[4-[(4-bromophenyl)methyl]piperidin-1-yl]-4-methylpiperidin-1-yl]-(2,6-dimethylphenyl)methanone BDBM50104943 [ Show all ]
Inchi Key	ZVCMZXYHBQKEGX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H35BrN2O/c1-20-5-4-6-21(2)25(20)26(31)29-17-13-27(3,14-18-29)30-15-11-23(12-16-30)19-22-7-9-24(28)10-8-22/h4-10,23H,11-19H2,1-3H3
PubChem CID	457875
ChEMBL	CHEMBL106247
IUPHAR	N/A
BindingDB	50104943
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
438248	C-C chemokine receptor type 5	P51682	Ccr5	Mus musculus (Mouse)	354
438249	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352
438250	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466

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