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Name | Cannabinoid receptor 2 |
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Species | Rattus norvegicus (Rat) |
Gene | Cnr2 |
Synonym | Peripheral cannabinoid receptor CB2-R CB2 receptor CB2 CB-2 [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 360 |
Amino acid sequence | MAGCRELELTNGSNGGLEFNPMKEYMILSDAQQIAVAVLCTLMGLLSALENVAVLYLILSSQRLRRKPSYLFIGSLAGADFLASVIFACNFVIFHVFHGVDSRNIFLLKIGSVTMTFTASVGSLLLTAVDRYLCLCYPPTYKALVTRGRALVALGVMWVLSALISYLPLMGWTCCPSPCSELFPLIPNDYLLGWLLFIAILFSGIIYTYGYVLWKAHQHVASLAEHQDRQVPGIARMRLDVRLAKTLGLVMAVLLICWFPALALMGHSLVTTLSDKVKEAFAFCSMLCLVNSMINPIIYALRSGEIRSAAQHCLTGWKKYLQGLGSEGKEEAPKSSVTETEAEVKTTTGPGSRTPGCSNC |
UniProt | Q9QZN9 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL2470 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL3354942 |
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Molecular formula | C23H21F2N3O |
IUPAC name | (2R,4R)-9-(2,4-difluorophenyl)-N-(2-phenylpropan-2-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene-7-carboxamide |
Molecular weight | 393.438 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 4.3 |
Synonyms | HZJISAONKFNAPO-CZUORRHYSA-N (1aR,5aR)-2-(2,4-Difluoro-phenyl)-1a,2,5,5a-tetrahydro-1H-2,3-diaza-cyclopropa[a]pentalene-4-carboxylic Acid (1-Methyl-1-phenyl-ethyl)-amide BDBM50041001 |
Inchi Key | HZJISAONKFNAPO-CZUORRHYSA-N |
Inchi ID | InChI=1S/C23H21F2N3O/c1-23(2,14-6-4-3-5-7-14)26-22(29)20-17-11-13-10-16(13)21(17)28(27-20)19-9-8-15(24)12-18(19)25/h3-9,12-13,16H,10-11H2,1-2H3,(H,26,29)/t13-,16-/m1/s1 |
PubChem CID | 86688562 |
ChEMBL | CHEMBL3354942 |
IUPHAR | N/A |
BindingDB | 50041001 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 52.0 nM | PMID25488844 | BindingDB,ChEMBL |
Emax | 15.0 % | PMID25488844 | ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417