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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.
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Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Beta-2 adrenergic receptor
Species	Mus musculus (Mouse)
Gene	Adrb2
Synonym	beta2-adrenoceptor beta-2 adrenoreceptor Beta-2 adrenoceptor beta-2 adrenergic receptor Adrb-2 beta 2-AR B2AR adrenoceptor beta 2, surface adrenergic receptor ADRBR ADRB2R Gpcr7 [ Show all ]
Disease	N/A for non-human GPCRs
Length	418
Amino acid sequence	MGPHGNDSDFLLAPNGSRAPDHDVTQERDEAWVVGMAILMSVIVLAIVFGNVLVITAIAKFERLQTVTNYFIISLACADLVMGLAVVPFGASHILMKMWNFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYVAITSPFKYQSLLTKNKARVVILMVWIVSGLTSFLPIQMHWYRATHKKAIDCYTEETCCDFFTNQAYAIASSIVSFYVPLVVMVFVYSRVFQVAKRQLQKIDKSEGRFHAQNLSQVEQDGRSGHGLRRSSKFCLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIRDNLIPKEVYILLNWLGYVNSAFNPLIYCRSPDFRIAFQELLCLRRSSSKTYGNGYSSNSNGRTDYTGEPNTCQLGQEREQELLCEDPPGMEGFVNCQGTVPSLSVDSQGRNCSTNDSPL
UniProt	P18762
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	CHEMBL3707
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	BW-723C86
Molecular formula	C16H18N2OS
IUPAC name	1-[5-(thiophen-2-ylmethoxy)-1H-indol-3-yl]propan-2-amine
Molecular weight	286.393
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	3.0
Synonyms	alpha-methyl-5-(2-thienylmethoxy)-1H-indole-3-ethanamine CAS_5311036 Lopac0_000217 SCHEMBL3298862 BPBio1_000023 NCGC00015135-04 BW-72386 GTPL161 NCGC00024972-03 BDBM82472 CCG-204312 MLS-0317858 1-[5-(thiophen-2-ylmethoxy)-1H-indol-3-yl]propan-2-amine BRD-A17428743-001-01-1 CHEMBL1255834 NCGC00015135-05 AC1N7TG2 L000152 NSC_5311036 Biomol-NT_000128 CHEBI:91556 NCGC00015135-03 BRD-A17428743-003-03-3 D00ZCU NCGC00024972-02 [ Show all ]
Inchi Key	ALFGDCNSEBJYSP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H18N2OS/c1-11(17)7-12-9-18-16-5-4-13(8-15(12)16)19-10-14-3-2-6-20-14/h2-6,8-9,11,18H,7,10,17H2,1H3
PubChem CID	4284720
ChEMBL	CHEMBL1255834
IUPHAR	161
BindingDB	82472
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	<10000.0 nM	PMID8730737	BindingDB

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