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GPCR

Name	Muscarinic acetylcholine receptor M2
Species	Homo sapiens (Human)
Gene	CHRM2
Synonym	cholinergic receptor AChR M2 M2 muscarinic acetylcholine receptor M2 receptor Chrm-2 cholinergic receptor, muscarinic 2, cardiac cholinergic receptor, muscarinic 2 [ Show all ]
Disease	Urinary incontinence Heart failure Nausea; Addiction Parkinson's disease Peptic ulcer Stabilize muscle contractions Unspecified Cardiovascular disorder Asthma Alzheimer disease [ Show all ]
Length	466
Amino acid sequence	MNNSTNSSNNSLALTSPYKTFEVVFIVLVAGSLSLVTIIGNILVMVSIKVNRHLQTVNNYFLFSLACADLIIGVFSMNLYTLYTVIGYWPLGPVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPVKRTTKMAGMMIAAAWVLSFILWAPAILFWQFIVGVRTVEDGECYIQFFSNAAVTFGTAIAAFYLPVIIMTVLYWHISRASKSRIKKDKKEPVANQDPVSPSLVQGRIVKPNNNNMPSSDDGLEHNKIQNGKAPRDPVTENCVQGEEKESSNDSTSVSAVASNMRDDEITQDENTVSTSLGHSKDENSKQTCIRIGTKTPKSDSCTPTNTTVEVVGSSGQNGDEKQNIVARKIVKMTKQPAKKKPPPSREKKVTRTILAILLAFIITWAPYNVMVLINTFCAPCIPNTVWTIGYWLCYINSTINPACYALCNATFKKTFKHLLMCHYKNIGATR
UniProt	P08172
Protein Data Bank	5zkc, 4mqs, 4mqt, 5yc8, 5zk3, 5zkb, 5zk8
GPCR-HGmod model	P08172
3D structure model	This structure is from PDB ID 5zkc.
BioLiP	BL0433341, BL0433216, BL0263147, BL0263146, BL0263145, BL0433339, BL0433340, BL0433338
Therapeutic Target Database	T46185
ChEMBL	CHEMBL211
IUPHAR	14
DrugBank	BE0000560

Ligand

Name	W-84 dibromide
Molecular formula	C32H44Br2N4O4
IUPAC name	3-(1,3-dioxoisoindol-2-yl)propyl-[6-[3-(1,3-dioxoisoindol-2-yl)propyl-dimethylazaniumyl]hexyl]-dimethylazanium;dibromide
Molecular weight	708.536
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	None
Synonyms	3-(1,3-dioxo-2-isoindolyl)propyl-[6-[3-(1,3-dioxo-2-isoindolyl)propyl-dimethylammonio]hexyl]-dimethylammonium dibromide C-23460 J-013837 A815135 DB-045480 N1,N6-bis(3-(1,3-dioxoisoindolin-2-yl)propyl)-N1,N1,N6,N6-tetramethylhexane-1,6-diaminium bromide 1,6-Hexanediaminium, N,N'-bis(3-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)propyl)-N,N,N',N'-tetramethyl-, dibromide AKOS024458552 Hexamethylene-bis-[dimethyl-(3-phthalimidopropyl)ammonium]dibromide SR-01000597956-1 W-84 dibromide, >=98% (HPLC), solid 3-(1,3-dioxoisoindol-2-yl)propyl-[6-[3-(1,3-dioxoisoindol-2-yl)propyl-dimethylazaniumyl]hexyl]-dimethylazanium dibromide MolPort-003-959-934 AC1L50XH FT-0638093 SCHEMBL3989856 21093-51-6 B6338 Hexamethylenebis(dimethyl-(3-phthalimidopropyl)ammonium bromide) W 84 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl-[6-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl-dimethyl-azaniumyl]hexyl]-dimethyl-azanium dibromide CHEMBL266295 n,n'-bis[3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propyl]-n,n,n',n'-tetramethylhexane-1,6-diaminium dibromide AC1Q1R6J Hexamethylene-bis-[dimethyl-(3-phthalimidopropyl)ammonium] dibromide SR-01000597956 [ Show all ]
Inchi Key	DZRJZDQAGMZGGA-UHFFFAOYSA-L
Inchi ID	InChI=1S/C32H44N4O4.2BrH/c1-35(2,23-13-19-33-29(37)25-15-7-8-16-26(25)30(33)38)21-11-5-6-12-22-36(3,4)24-14-20-34-31(39)27-17-9-10-18-28(27)32(34)40;;/h7-10,15-18H,5-6,11-14,19-24H2,1-4H3;2*1H/q+2;;/p-2
PubChem CID	167961
ChEMBL	CHEMBL266295
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available.

Experimental Data

Parameter	Value	Reference	Database source
pKA	6.55 -	PMID25051097	ChEMBL
pKA	6.59 -	PMID25051097	ChEMBL

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