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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Muscarinic acetylcholine receptor M2
Species	Rattus norvegicus (Rat)
Gene	Chrm2
Synonym	cholinergic receptor cholinergic receptor, muscarinic 2 AChR M2 Chrm-2 M2 muscarinic acetylcholine receptor M2 receptor cholinergic receptor, muscarinic 2, cardiac [ Show all ]
Disease	N/A for non-human GPCRs
Length	466
Amino acid sequence	MNNSTNSSNNGLAITSPYKTFEVVFIVLVAGSLSLVTIIGNILVMVSIKVNRHLQTVNNYFLFSLACADLIIGVFSMNLYTLYTVIGYWPLGPVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPVKRTTKMAGMMIAAAWVLSFILWAPAILFWQFIVGVRTVEDGECYIQFFSNAAVTFGTAIAAFYLPVIIMTVLYWHISRASKSRIKKEKKEPVANQDPVSPSLVQGRIVKPNNNNMPGGDGGLEHNKIQNGKAPRDGVTENCVQGEEKESSNDSTSVSAVASNMRDDEITQDENTVSTSLGHSRDDNSKQTCIKIVTKAQKGDVCTPTSTTVELVGSSGQNGDEKQNIVARKIVKMTKQPAKKKPPPSREKKVTRTILAILLAFIITWAPYNVMVLINTFCAPCIPNTVWTIGYWLCYINSTINPACYALCNATFKKTFKHLLMCHYKNIGATR
UniProt	P10980
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL309
IUPHAR	14
DrugBank	N/A

Ligand

Name	CHEMBL115642
Molecular formula	C36H44N2O6S
IUPAC name	[4-[4-[(4R,5R)-2-[4-(4-methoxyphenyl)sulfonylphenyl]-4,5-dimethyl-1,3-dioxolan-2-yl]piperidin-1-yl]piperidin-1-yl]-(2-methylphenyl)methanone
Molecular weight	632.816
Hydrogen bond acceptor	7
Hydrogen bond donor	0
XlogP	5.6
Synonyms	(4-{(4R,5R)-2-[4-(4-Methoxy-benzenesulfonyl)-phenyl]-4,5-dimethyl-[1,3]dioxolan-2-yl}-[1,4'']bipiperidinyl-1''-yl)-o-tolyl-methanone BDBM50121122 2-Methylphenyl[4-[4-[(4R)-2-[4-(4-methoxyphenylsulfonyl)phenyl]-4alpha,5beta-dimethyl-1,3-dioxolane-2-yl]piperidino]piperidino] ketone
Inchi Key	CPGXIQUYLPQZQK-KAYWLYCHSA-N
Inchi ID	InChI=1S/C36H44N2O6S/c1-25-7-5-6-8-34(25)35(39)38-23-19-30(20-24-38)37-21-17-29(18-22-37)36(43-26(2)27(3)44-36)28-9-13-32(14-10-28)45(40,41)33-15-11-31(42-4)12-16-33/h5-16,26-27,29-30H,17-24H2,1-4H3/t26-,27-/m1/s1
PubChem CID	44344029
ChEMBL	CHEMBL115642
IUPHAR	N/A
BindingDB	50121122
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.

Experimental Data

Parameter	Value	Reference	Database source
Ki	18.0 nM	PMID12419388	BindingDB,ChEMBL

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