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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	CHEMBL3417223
Molecular formula	C35H39F3N2O2
IUPAC name	[(1S,3R)-3-[[5-(3-methoxyphenyl)-2,3-dihydro-1H-inden-1-yl]amino]-1-propan-2-ylcyclopentyl]-[7-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone
Molecular weight	576.704
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	7.3
Synonyms	BDBM50077920
Inchi Key	APPSTWKASLEFLV-VJVBZRJBSA-N
Inchi ID	InChI=1S/C35H39F3N2O2/c1-22(2)34(33(41)40-16-14-23-7-10-28(35(36,37)38)18-27(23)21-40)15-13-29(20-34)39-32-12-9-26-17-25(8-11-31(26)32)24-5-4-6-30(19-24)42-3/h4-8,10-11,17-19,22,29,32,39H,9,12-16,20-21H2,1-3H3/t29-,32?,34+/m1/s1
PubChem CID	118734678
ChEMBL	CHEMBL3417223
IUPHAR	N/A
BindingDB	50077920
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. 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
442144	C-C chemokine receptor type 2	P41597	CCR2	Homo sapiens (Human)	374

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