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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

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

Ligand

Name	formoterol
Molecular formula	C19H24N2O4
IUPAC name	N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide
Molecular weight	344.411
Hydrogen bond acceptor	5
Hydrogen bond donor	4
XlogP	1.8
Synonyms	CGP-25827A eformoterol Formoterol tartrate Modulite (TN) NCGC00181126-01 Perforomist (TN) Atimos (TN) CHEMBL1256786 Foradile Formoterolum n-[2-hydroxy-5-(1-hydroxy-2-{[1-(4-methoxyphenyl)propan-2-yl]amino}ethyl)phenyl]formamide Oxeze Turbuhaler STL450992 2'-hydroxy-5'-(1-hydroxy-2-((p-methoxy-alpha-methylphenethyl)amino)ethyl)formanilide AC1L1FVE BD-40A C07805 Formoterol (INN) K252 N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide Oxis AN-15811 CHEBI:63082 Foradil Formoterol [USAN:INN:BAN] MOLI000351 NSC_3083544 SCHEMBL15856256 (+-)-2'-Hydroxy-5'-((RS)-1-hydroxy-2-(((RS)-p-methoxy-alpha-methylphenethyl)amino)ethyl)formanilide AB0014121 Atock (TN) BDBM86453 D04KJO Foradile (TN) Formoterolum [INN-Latin] N-[2-hydroxy-5-(1-hydroxy-2-{[2-(4-methoxyphenyl)-1-methylethyl]amino}ethyl)phenyl]formamide Oxeze Turbuhaler Foradil VA10968 2'-hydroxy-5'-{1-hydroxy-2-[(p-methoxy-alpha-methylphenethyl)amino]ethyl}formanilide AC1Q6QRX CAS_73573-87-2 DB00983 FORMOTEROL FUMARATE L000259 N-[2-hydroxy-5-[1-hydroxy-2-[[2-(4-methoxyphenyl)-1-methyl-ethyl]amino]ethyl]phenyl]formamide Oxis (TN) 73573-87-2 AS-14186 Foradil (TN) Formoterol, ((R,R)-(+-)-)-isomer MolPort-005-934-219 Oxeze (TN) SCHEMBL349579 AC-459 BC205764 BPZSYCZIITTYBL-UHFFFAOYSA-N D07990 GTPL3465 N-[2-hydroxy-5-[(1R)-1-hydroxy-2-[[(2S)-1-(4-methoxyphenyl)propan-2-yl]amino]ethyl]phenyl]formamide Oxeze/Oxis 3-formylamino-4-hydroxy-alpha-(N-1-methyl-2-p-methoxyphenethylaminomethyl)benzyl alcohol.hemifumarate AKOS015961179 [ Show all ]
Inchi Key	BPZSYCZIITTYBL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H24N2O4/c1-13(9-14-3-6-16(25-2)7-4-14)20-11-19(24)15-5-8-18(23)17(10-15)21-12-22/h3-8,10,12-13,19-20,23-24H,9,11H2,1-2H3,(H,21,22)
PubChem CID	3410
ChEMBL	CHEMBL1256786
IUPHAR	3465
BindingDB	86453
DrugBank	DB00983
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	1.585 nM	PMID24813741	ChEMBL
EC50	1.6 nM	PMID24813741	BindingDB
IC50	0.4 nM	PMID25065493	BindingDB
IC50	0.4 nM	PMID25065493	ChEMBL
Intrinsic activity	0.9 -	PMID24900851	ChEMBL
pA50	8.8 -	PMID24900851	ChEMBL
TIME	0.3833 hr	PMID24900851	ChEMBL
TIME	0.4667 hr	PMID25065493	ChEMBL
TIME	1.2 hr	PMID25065493	ChEMBL

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