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Name | Cannabinoid receptor 2 |
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Species | Homo sapiens (Human) |
Gene | CNR2 |
Synonym | Peripheral cannabinoid receptor rCB2 hCB2 cannabinoid receptor 2 (macrophage) cannabinoid receptor 2 (spleen) [ Show all ] |
Disease | Immune disorder Inflammatory bowel disease Inflammatory disease Neuropathic pain Osteoporosis [ 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 |
Name | CHEMBL1762420 |
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Molecular formula | C18H28N4O4 |
IUPAC name | N-(5-tert-butyl-1,2-oxazol-3-yl)-4-(oxolane-3-carbonyl)-1,4-diazepane-1-carboxamide |
Molecular weight | 364.446 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 1.2 |
Synonyms | BDBM50341001 N-(5-tert-butylisoxazol-3-yl)-4-(tetrahydrofuran-3-carbonyl)-1,4-diazepane-1-carboxamide SCHEMBL10253463 |
Inchi Key | ADIUSHICVCCMIJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H28N4O4/c1-18(2,3)14-11-15(20-26-14)19-17(24)22-7-4-6-21(8-9-22)16(23)13-5-10-25-12-13/h11,13H,4-10,12H2,1-3H3,(H,19,20,24) |
PubChem CID | 54583926 |
ChEMBL | CHEMBL1762420 |
IUPHAR | N/A |
BindingDB | 50341001 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Activity | 100.0 % | PMID21354795 | ChEMBL |
EC50 | 2300.0 nM | PMID21354795 | BindingDB,ChEMBL |
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