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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	CHEMBL190459
Molecular formula	C23H29NO4
IUPAC name	4-(3-azabicyclo[3.1.0]hexan-3-yl)but-2-ynyl 2-cyclopentyl-2-hydroxy-2-(4-methoxyphenyl)acetate
Molecular weight	383.488
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	3.3
Synonyms	N-[4-(3-Aza-bicyclo[3.1.0]hex-3-yl)-but-2-ynyl]-2-cyclopentyl-2-hydroxy-2-phenyl-acetamide BDBM50165014 Cyclopentyl-hydroxy-(4-methoxy-phenyl)-acetic acid 4-(3-aza-bicyclo[3.1.0]hex-3-yl)-but-2-ynyl ester
Inchi Key	FVUJGTUMLXJKBD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H29NO4/c1-27-21-10-8-20(9-11-21)23(26,19-6-2-3-7-19)22(25)28-13-5-4-12-24-15-17-14-18(17)16-24/h8-11,17-19,26H,2-3,6-7,12-16H2,1H3
PubChem CID	44400218
ChEMBL	CHEMBL190459
IUPHAR	N/A
BindingDB	50165014
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
88519	Muscarinic acetylcholine receptor M2	P10980	Chrm2	Rattus norvegicus (Rat)	466
88518	Muscarinic acetylcholine receptor M3	P08483	Chrm3	Rattus norvegicus (Rat)	589

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