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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	CHEMBL1684690
Molecular formula	C24H39N3O3
IUPAC name	cyclobutyl-[(1S,4S)-5-[(1S,3R)-3-(oxan-4-ylamino)-1-propan-2-ylcyclopentanecarbonyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]methanone
Molecular weight	417.594
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.3
Synonyms	BDBM50338119 ((1S,4S)-5-(cyclobutanecarbonyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl)((1S,3R)-1-isopropyl-3-(tetrahydro-2H-pyran-4-ylamino)cyclopentyl)methanone
Inchi Key	ALRXKRMHPSRFAG-XBJMDHIQSA-N
Inchi ID	InChI=1S/C24H39N3O3/c1-16(2)24(9-6-19(13-24)25-18-7-10-30-11-8-18)23(29)27-15-20-12-21(27)14-26(20)22(28)17-4-3-5-17/h16-21,25H,3-15H2,1-2H3/t19-,20+,21+,24+/m1/s1
PubChem CID	53320349
ChEMBL	CHEMBL1684690
IUPHAR	N/A
BindingDB	50338119
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
8541	C-C chemokine receptor type 2	P41597	CCR2	Homo sapiens (Human)	374

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