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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Cannabinoid receptor 2
Species	Homo sapiens (Human)
Gene	CNR2
Synonym	Peripheral cannabinoid receptor rCB2 hCB2 cannabinoid receptor 2 (macrophage) cannabinoid receptor 2 (spleen) CB-2 CB2 CB2 receptor CB2-R CX5 [ Show all ]
Disease	Immune disorder Inflammatory bowel disease Inflammatory disease Neuropathic pain Osteoporosis Pain Atopic dermatitis Rheumatoid arthritis [ Show all ]
Length	360
Amino acid sequence	MEECWVTEIANGSKDGLDSNPMKDYMILSGPQKTAVAVLCTLLGLLSALENVAVLYLILSSHQLRRKPSYLFIGSLAGADFLASVVFACSFVNFHVFHGVDSKAVFLLKIGSVTMTFTASVGSLLLTAIDRYLCLRYPPSYKALLTRGRALVTLGIMWVLSALVSYLPLMGWTCCPRPCSELFPLIPNDYLLSWLLFIAFLFSGIIYTYGHVLWKAHQHVASLSGHQDRQVPGMARMRLDVRLAKTLGLVLAVLLICWFPVLALMAHSLATTLSDQVKKAFAFCSMLCLINSMVNPVIYALRSGEIRSSAHHCLAHWKKCVRGLGSEAKEEAPRSSVTETEADGKITPWPDSRDLDLSDC
UniProt	P34972
Protein Data Bank	5zty
GPCR-HGmod model	P34972
3D structure model	This structure is from PDB ID 5zty.
BioLiP	BL0438927
Therapeutic Target Database	T37693
ChEMBL	CHEMBL253
IUPHAR	57
DrugBank	BE0000095

Ligand

Name	CHEMBL309042
Molecular formula	C23H38FNO
IUPAC name	(5Z,8Z,11Z,14Z)-N-(2-fluoroethyl)-2-methylicosa-5,8,11,14-tetraenamide
Molecular weight	363.561
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	7.0
Synonyms	J-010256 SR-01000946638 (+/-)-2-Methylarachidonoyl-2'-fluoroethylamide MolPort-009-018-834 (5Z,8Z,11Z,14Z)-N-(2-fluoroethyl)-2-methylicosa-5,8,11,14-tetraenamide BDBM50060617 Fluoromethanandamide N-(2-fluro-ethyl)2-methylarachidonoylamide 2-Methyl-icosa-5,8,11,14-tetraenoic acid (2-fluoro-ethyl)-amide (0689) LMFA08020056 SR-01000946638-1 (+/-)-2-Methylarachidonoyl-2'-fluoroethylamide, >=95%, ethanol solution AC1NR2AD N-(2-fluro-ethyl) 2-methyl-arachidonoyl amine 166100-39-6 HMS3649B17 SCHEMBL12631857 2-methylarachidonoyl-(2'-fluoroethyl)amide MFCD01862615 (5Z,8Z,11Z,14Z)-2-Methyl-icosa-5,8,11,14-tetraenoic acid (2-fluoro-ethyl)-amide AKOS030531014 N-(2-fluro-ethyl)-2-methyl-5Z,8Z,11Z,14Z-eicosatetraenoyl amine 2-Methyl-2'-fluoro AEA [ Show all ]
Inchi Key	HMMNZALKMVCHHZ-ZKWNWVNESA-N
Inchi ID	InChI=1S/C23H38FNO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(2)23(26)25-21-20-24/h7-8,10-11,13-14,16-17,22H,3-6,9,12,15,18-21H2,1-2H3,(H,25,26)/b8-7-,11-10-,14-13-,17-16-
PubChem CID	5283437
ChEMBL	CHEMBL309042
IUPHAR	N/A
BindingDB	50060617
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
Log Ki	2.12 nM	PMID10882356	ChEMBL

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