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Name | Beta-2 adrenergic receptor |
---|---|
Species | Cavia porcellus (Guinea pig) |
Gene | Adrb2 |
Synonym | Beta-2 adrenoceptor Beta-2 adrenoreceptor |
Disease | N/A for non-human GPCRs |
Length | 418 |
Amino acid sequence | MGHLGNGSDFLLAPNASHAPDHNVTRERDEAWVVGMAIVMSLIVLAIVFGNVLVITAIAKFERLQTVTNYFITSLACADLVMGLAVVPFGASHILMNMWTFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYFAITSPFKYQSLLTKNKARVVILMVWVVSGLTSFLPIQMHWYRATHKDAINCYAEETCCDFFTNQAYAIASSIVSFYLPLVVMVFVYSRVFQVAKKQLQKIDRSEGRFHTQNLSQVEQDGRSGHGLRRSSKFYLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIQDNLIPKEVYILLNWVGYVNSAFNPLIYCRSPDFRIAFQELLCLRRSALKAYGNDCSSNSNGKTDYTGEPNVCHQGQEKERELLCEDPPGTEDLVSCPGTVPSDSIDSQGRNYSTNDSLL |
UniProt | Q8K4Z4 |
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 | CHEMBL5414 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL243266 |
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Molecular formula | C21H24N4O7 |
IUPAC name | 4-[[4-[2-[[2-(3,5-dihydroxyphenyl)-2-hydroxyethyl]amino]propyl]phenoxy]methyl]-2-oxido-1,2,5-oxadiazol-2-ium-3-carboxamide |
Molecular weight | 444.444 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 5 |
XlogP | 1.6 |
Synonyms | BDBM50221773 rac-4-(4-{(2R)-[2-(3,5-dihydroxyphenyl)-(2S)-hydroxyethylamino]propyl}phenoxymethyl)furoxan-3-carboxamide 4-(4-{2-[2-(3,5-dihydroxy-phenyl)-2-hydroxy-ethylamino]-propyl}-phenoxymethyl)-2-oxy-furazan-3-carboxylic acid amide |
Inchi Key | ATTPETUTYJEEIJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H24N4O7/c1-12(23-10-19(28)14-7-15(26)9-16(27)8-14)6-13-2-4-17(5-3-13)31-11-18-20(21(22)29)25(30)32-24-18/h2-5,7-9,12,19,23,26-28H,6,10-11H2,1H3,(H2,22,29) |
PubChem CID | 44428083 |
ChEMBL | CHEMBL243266 |
IUPHAR | N/A |
BindingDB | 50221773 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 110.0 nM | PMID17845020 | BindingDB,ChEMBL |
EC50 | 130.0 nM | PMID17845020 | BindingDB,ChEMBL |
EC50 | 1000.0 nM | PMID17845020 | BindingDB,ChEMBL |
EC50 | 1100.0 nM | PMID17845020 | BindingDB,ChEMBL |
EC50 | 22000.0 nM | PMID17845020 | BindingDB,ChEMBL |
EC50 | 24000.0 nM | PMID17845020 | BindingDB,ChEMBL |
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