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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	CHEMBL109051
Molecular formula	C35H37FN2O4S
IUPAC name	(4-fluoronaphthalen-1-yl)-[4-[4-[[4-(4-methoxyphenyl)sulfonylphenyl]methyl]piperidin-1-yl]piperidin-1-yl]methanone
Molecular weight	600.749
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	6.8
Synonyms	BDBM50104942 (4-Fluoro-naphthalen-1-yl)-{4-[4-(4-methoxy-benzenesulfonyl)-benzyl]-[1,4'']bipiperidinyl-1''-yl}-methanone
Inchi Key	XVOCHVRQMXWEQB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C35H37FN2O4S/c1-42-28-8-12-30(13-9-28)43(40,41)29-10-6-25(7-11-29)24-26-16-20-37(21-17-26)27-18-22-38(23-19-27)35(39)33-14-15-34(36)32-5-3-2-4-31(32)33/h2-15,26-27H,16-24H2,1H3
PubChem CID	44337326
ChEMBL	CHEMBL109051
IUPHAR	N/A
BindingDB	50104942
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. 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
402003	C-C chemokine receptor type 5	P51682	Ccr5	Mus musculus (Mouse)	354
402005	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352
402004	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466

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