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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	CHEMBL3219780
Molecular formula	C29H42F2N6O
IUPAC name	N-[(1S)-1-(4-aminophenyl)-3-[3-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-4,4-difluorocyclohexane-1-carboxamide
Molecular weight	528.693
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	4.5
Synonyms	SCHEMBL16276164
Inchi Key	FURIEPCHQHZWDN-ILVMPNSOSA-N
Inchi ID	InChI=1S/C29H42F2N6O/c1-18(2)27-35-34-19(3)37(27)25-16-23-8-9-24(17-25)36(23)15-12-26(20-4-6-22(32)7-5-20)33-28(38)21-10-13-29(30,31)14-11-21/h4-7,18,21,23-26H,8-17,32H2,1-3H3,(H,33,38)/t23?,24?,25?,26-/m0/s1
PubChem CID	90666578
ChEMBL	CHEMBL3219780
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
87681	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352
87682	C-C chemokine receptor type 5	P61813	CCR5	Macaca mulatta (Rhesus macaque)	352

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