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Name | Beta-2 adrenergic receptor |
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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 | CHEMBL3323665 |
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Molecular formula | C20H24N2O3S |
IUPAC name | 4-hydroxy-7-[(1R)-1-hydroxy-2-[2-(4-propylphenyl)ethylamino]ethyl]-3H-1,3-benzothiazol-2-one |
Molecular weight | 372.483 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 4 |
XlogP | 3.3 |
Synonyms | BDBM50055255 |
Inchi Key | CDDUMSDWPMBQGF-KRWDZBQOSA-N |
Inchi ID | InChI=1S/C20H24N2O3S/c1-2-3-13-4-6-14(7-5-13)10-11-21-12-17(24)15-8-9-16(23)18-19(15)26-20(25)22-18/h4-9,17,21,23-24H,2-3,10-12H2,1H3,(H,22,25)/t17-/m0/s1 |
PubChem CID | 10406968 |
ChEMBL | CHEMBL3323665 |
IUPHAR | N/A |
BindingDB | 50055255 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 14.0 nM | PMID25065493 | BindingDB,ChEMBL |
TIME | 0.6 hr | PMID25065493 | ChEMBL |
TIME | 6.4 hr | PMID25065493 | ChEMBL |
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