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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	CHEMBL400038
Molecular formula	C22H26N3O2S+
IUPAC name	(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) N-[(3-cyanophenyl)methyl]-N-thiophen-3-ylcarbamate
Molecular weight	396.529
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	3.8
Synonyms	3-[(3-cyano-benzyl)-thiophen-3-yl-carbamoyloxy]-8,8-dimethyl-8-azonia-bicyclo[3.2.1]octane; bromide BDBM50223966
Inchi Key	AJGAELFOKNDDKC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H26N3O2S/c1-25(2)19-6-7-20(25)12-21(11-19)27-22(26)24(18-8-9-28-15-18)14-17-5-3-4-16(10-17)13-23/h3-5,8-10,15,19-21H,6-7,11-12,14H2,1-2H3/q+1
PubChem CID	44434306
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50223966
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
6883	Muscarinic acetylcholine receptor M1	P11229	CHRM1	Homo sapiens (Human)	460
6884	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466
6882	Muscarinic acetylcholine receptor M3	P20309	CHRM3	Homo sapiens (Human)	590

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