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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	CHEMBL163813
Molecular formula	C26H34ClNO3S
IUPAC name	propyl 2-(3-chlorophenyl)-4,6-diethyl-5-hexylsulfanylcarbonylpyridine-3-carboxylate
Molecular weight	476.072
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	8.2
Synonyms	BDBM50074227 2-(3-Chloro-phenyl)-4,6-diethyl-5-hexylsulfanylcarbonyl-nicotinic acid propyl ester
Inchi Key	APMWCJWGZQDHJU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H34ClNO3S/c1-5-9-10-11-16-32-26(30)22-20(7-3)23(25(29)31-15-6-2)24(28-21(22)8-4)18-13-12-14-19(27)17-18/h12-14,17H,5-11,15-16H2,1-4H3
PubChem CID	10719352
ChEMBL	CHEMBL163813
IUPHAR	N/A
BindingDB	50074227
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

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
11135	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
11136	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
11134	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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