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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 | CHEMBL2381674 |
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Molecular formula | C26H32N4O3 |
IUPAC name | N-(1-adamantyl)-2-(furan-2-yl)-7-oxo-4-pentylpyrazolo[1,5-a]pyrimidine-6-carboxamide |
Molecular weight | 448.567 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 5.2 |
Synonyms | N-(Adamantane-1-yl)-2-(2-furanyl)-4,7-dihydro-4-pentyl-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxamide |
Inchi Key | HBXGMYPLVUUOLH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H32N4O3/c1-2-3-4-7-29-16-20(25(32)30-23(29)12-21(28-30)22-6-5-8-33-22)24(31)27-26-13-17-9-18(14-26)11-19(10-17)15-26/h5-6,8,12,16-19H,2-4,7,9-11,13-15H2,1H3,(H,27,31) |
PubChem CID | 71681350 |
ChEMBL | CHEMBL2381674 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Activity | 107.0 % | PMID23697626 | ChEMBL |
Activity | 124.0 % | PMID23697626 | ChEMBL |
Ki | 4.92 nM | PMID23697626 | ChEMBL |
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