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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	DIHYDROALPRENOLOL
Molecular formula	C15H25NO2
IUPAC name	1-(propan-2-ylamino)-3-(2-propylphenoxy)propan-2-ol
Molecular weight	251.37
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	3.4
Synonyms	Dihydroalprenolol,(+/-) CAS_43216 PDSP1_000153 [3H]dihydroalprenolol 2-Propanol, 1-((1-methylethyl)amino)-3-(2-propylphenoxy)- D01YDO AC1L29EI LS-176066 1-((Methylethyl)amino)-3-(2-propylphenoxy)-2-propanol PDSP2_000152 60106-89-0 BDBM81447 NSC_43216 [3H]-dihydroalprenolol 1-(propan-2-ylamino)-3-(2-propylphenoxy)propan-2-ol CHEMBL1159723 [ Show all ]
Inchi Key	JVHCMYZFGCOCTD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H25NO2/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3/h5-6,8-9,12,14,16-17H,4,7,10-11H2,1-3H3
PubChem CID	43216
ChEMBL	CHEMBL1159723
IUPHAR	N/A
BindingDB	81447
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	13.05 -	PMID2836587	ChEMBL
-Log KD	9.2 -	PMID2993621	ChEMBL
Kd	0.63 nM	PMID2993621	BindingDB
Kd	0.63 nM	PMID2993621	ChEMBL

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