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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	CHEMBL127587
Molecular formula	C18H22INO3
IUPAC name	[(3R)-1-azabicyclo[2.2.2]octan-3-yl] (E,2R)-2-hydroxy-5-iodo-2-phenylpent-4-enoate
Molecular weight	427.282
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	3.2
Synonyms	(2R,4E)-2-Hydroxy-2-phenyl-5-iodo-4-pentenoic acid 1-azabicyclo[2.2.2]octan-3alpha-yl ester BDBM50031098 (E)-(R)-2-Hydroxy-5-iodo-2-phenyl-pent-4-enoic acid (R)-(1-aza-bicyclo[2.2.2]oct-3-yl) ester
Inchi Key	MMUQVFDMUDOFSH-UCPUOCAQSA-N
Inchi ID	InChI=1S/C18H22INO3/c19-10-4-9-18(22,15-5-2-1-3-6-15)17(21)23-16-13-20-11-7-14(16)8-12-20/h1-6,10,14,16,22H,7-9,11-13H2/b10-4+/t16-,18+/m0/s1
PubChem CID	10365181
ChEMBL	CHEMBL127587
IUPHAR	N/A
BindingDB	50031098
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
209337	Muscarinic acetylcholine receptor M1	P08482	Chrm1	Rattus norvegicus (Rat)	460
209338	Muscarinic acetylcholine receptor M2	P10980	Chrm2	Rattus norvegicus (Rat)	466
209339	Muscarinic acetylcholine receptor M4	P08485	Chrm4	Rattus norvegicus (Rat)	478

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