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Name | Beta-3 adrenergic receptor |
---|---|
Species | Macaca mulatta (Rhesus macaque) |
Gene | ADRB3 |
Synonym | Beta-3 adrenoceptor Beta-3 adrenoreceptor |
Disease | N/A for non-human GPCRs |
Length | 418 |
Amino acid sequence | MAPWPHGNSSLVPWPDVPTLAPNTANTSGLPGVPWAAALAGALLALAVLATVGGNLLVIVAITRTPRLQTMTNVFVTSLAAADLVMGLLVVPPAATLVLTGHWPLGATGCELWTSVDVLCVTASIETLCALAVDRYLAVTNPLRYGALVTKRRARAAVVLVWVVSAAVSFAPIMSQWWRVGADAEAQRCHSNPRCCAFASNMPYVLLSSSVSFYLPLLVMLFVYARVFVVATRQLRLLRWELGRFPPEESSPALSRSLAPAPAGTCAPPEGVPACCRRPARLLPLREHRALCTLGLIMGTFTLCWLPFFLANVLRALGGPSLVPDPAFLALNWLGYANSAFNPLIYCRSPDFRSAFRRLLCHCGGRLPREPCAADRPASSPRAPLRPGPAPRSPGFASGSTGLLGEFLRPEGQEATLR |
UniProt | Q28524 |
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 | CHEMBL3124732 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL3764088 |
---|---|
Molecular formula | C24H26N4O3 |
IUPAC name | N-[4-[[(2S,5R)-5-[(R)-hydroxy(phenyl)methyl]pyrrolidin-2-yl]methyl]phenyl]-2-(6-oxopyridazin-1-yl)acetamide |
Molecular weight | 418.497 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 1.7 |
Synonyms | BDBM50146156 SCHEMBL11982266 |
Inchi Key | URLFNGRPGJRFPI-YZUZCNPQSA-N |
Inchi ID | InChI=1S/C24H26N4O3/c29-22(16-28-23(30)7-4-14-25-28)27-19-10-8-17(9-11-19)15-20-12-13-21(26-20)24(31)18-5-2-1-3-6-18/h1-11,14,20-21,24,26,31H,12-13,15-16H2,(H,27,29)/t20-,21+,24+/m0/s1 |
PubChem CID | 44472610 |
ChEMBL | CHEMBL3764088 |
IUPHAR | N/A |
BindingDB | 50146156 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 3.5 nM | PMID26709102 | BindingDB,ChEMBL |
max activation | 91.0 % | PMID26709102 | ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417