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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Beta-2 adrenergic receptor
Species	Canis lupus familiaris (Dog)
Gene	ADRB2
Synonym	Beta-2 adrenoceptor Beta-2 adrenoreceptor
Disease	N/A for non-human GPCRs
Length	415
Amino acid sequence	MGQPANRSVFLLAPNGSHAPDQGDSQERSEAWVVGMGIVMSLIVLAIVFGNVLVITAIARFERLQTVTNYFITSLACADLVMGLAVVPFGASHILMKMWTFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYFAITSPFKYQSLLTKNKARVVILMVWIVSGLTSFLPIQMHWYRATHQEAINCYAKETCCDFFTNQAYAIASSIVSFYLPLVVMVFVYSRVFQVAQRQLQKIDRSEGRFHAQNLSQVEQDGRSGHGHRRSSKFCLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIQDNLIPKEVYILLNWVGYVNSAFNPLIYCRSPDFRIAFQELLCLRRSSLKAYGNGYSNNSNSRSDYAGEHSGCHLGQEKDSELLCEDPPGTEDRQGTVPSDSVDSQGRNCSTNDSLL
UniProt	P54833
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	CHEMBL2289
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	4-Hydroxypropranolol
Molecular formula	C16H21NO3
IUPAC name	4-[2-hydroxy-3-(propan-2-ylamino)propoxy]naphthalen-1-ol
Molecular weight	275.348
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	2.6
Synonyms	AC1Q7AX5 10476-53-6 4-[2-Hydroxy-3-(isopropylamino)propoxy]-1-naphthol # BDBM50405147 4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)-1-naphthalenol CTK8D5320 4-HYDROXYPROPRANOLOL SULFATE AKOS030547981 14133-90-5 (hydrochloride) 4-[2-hydroxy-3-(isopropylamino)propoxy]naphthalen-1-ol 4-HYDROXY PROPRANOLOL AC1L3MBY CWEPACWBWIOYID-UHFFFAOYSA-N 1-(4-Hydroxynaphth-1-yloxy)-3-isopropylamino-2-propanol 4-[2-Hydroxy-3-(isopropylamino)propoxy]-1-naphthol AN-36817 4'-hydroxypropanolol 4-[2-hydroxy-3-(propan-2-ylamino)propoxy]naphthalen-1-ol CHEMBL1137 [ Show all ]
Inchi Key	CWEPACWBWIOYID-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H21NO3/c1-11(2)17-9-12(18)10-20-16-8-7-15(19)13-5-3-4-6-14(13)16/h3-8,11-12,17-19H,9-10H2,1-2H3
PubChem CID	91565
ChEMBL	CHEMBL1137
IUPHAR	N/A
BindingDB	50405147
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Kd	2.399 nM	PMID6330358	ChEMBL
Kd	2.4 nM	PMID6330358	BindingDB
Vasodilation	4.82 -	PMID2861287	ChEMBL

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