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GLASS

You can:

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	Bos taurus (Bovine)
Gene	ADRB2
Synonym	Beta-2 adrenoceptor Beta-2 adrenoreceptor
Disease	N/A for non-human GPCRs
Length	418
Amino acid sequence	MGQPGNRSVFLLAPNASHAPDQNVTLERDEAWVVGMGILMSLIVLAIVFGNVLVITAIAKFERLQTVTNYFITSLACADLVMGLAVVPFGACHILMKMWTFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYLAITSPFKYQCLLTKNKARVVILMVWIVSGLTSFLPIQMHWYRASHKEAINCYAKETCCDFFTNQPYAIASSIVSFYLPLVVMVFVYSRVFQVAKRQLQKIDKSEGRFHAQNVSQVEQDGRSGLGQRRTSKFYLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIKDNLIRKEIYILLNWLGYINSAFNPLIYCRSPDFRIAFQELLCLRRSSLKAYGNGCSSNSNDRTDYTGEQSGYHLGEEKDSELLCEDPPGTENFVNQQGTVPSDSIDSQGRNCSTNDSLL
UniProt	Q28044
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	CHEMBL3373
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL1159719
Molecular formula	C11H18N2O2
IUPAC name	2-amino-4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenol
Molecular weight	210.277
Hydrogen bond acceptor	4
Hydrogen bond donor	4
XlogP	-0.9
Synonyms	SCHEMBL4428939 96948-68-4 1-(3-amino-4-hydroxyphenyl)-2-isopropylaminoethanol BDBM50421718 Du-21117
Inchi Key	FDKAXRPNTIXZOI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C11H18N2O2/c1-7(2)13-6-11(15)8-3-4-10(14)9(12)5-8/h3-5,7,11,13-15H,6,12H2,1-2H3
PubChem CID	10353067
ChEMBL	CHEMBL1159719
IUPHAR	N/A
BindingDB	50421718
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
-Delta G	7.93 -	PMID2836587	ChEMBL
-Log KD	5.59 -	PMID2993621	ChEMBL
Kd	5130.0 nM	PMID2993621	BindingDB,ChEMBL

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