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GLASS

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

Name	Adenosine receptor A2b
Species	Rattus norvegicus (Rat)
Gene	Adora2b
Synonym	A2b A2B receptor A2BR adenosine receptor A2b
Disease	N/A for non-human GPCRs
Length	332
Amino acid sequence	MQLETQDALYVALELVIAALAVAGNVLVCAAVGASSALQTPTNYFLVSLATADVAVGLFAIPFAITISLGFCTDFHSCLFLACFVLVLTQSSIFSLLAVAVDRYLAIRVPLRYKGLVTGTRARGIIAVLWVLAFGIGLTPFLGWNSKDRATSNCTEPGDGITNKSCCPVKCLFENVVPMSYMVYFNFFGCVLPPLLIMMVIYIKIFMVACKQLQHMELMEHSRTTLQREIHAAKSLAMIVGIFALCWLPVHAINCITLFHPALAKDKPKWVMNVAILLSHANSVVNPIVYAYRNRDFRYSFHRIISRYVLCQTDTKGGSGQAGGQSTFSLSL
UniProt	P29276
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	CHEMBL2592
IUPHAR	20
DrugBank	N/A

Ligand

Name	IDAZOXAN
Molecular formula	C11H12N2O2
IUPAC name	2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4,5-dihydro-1H-imidazole
Molecular weight	204.229
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	0.7
Synonyms	Tox21_110173 2-(2,3-Dihydro-1,4-benzodioxin-2-yl)-4,5-dihydro-1H-imidazole AB00514632 BRD-A18696154-003-14-3 DB12551 I14-6697 Idazoxano [Spanish] NCGC00015560-06 Prestwick1_000926 AN-36529 CAS-79944-58-4 DSSTox_RID_80711 Idazoxan [BAN:INN] L000808 NCGC00015560-10 RX-781094 1H-Imidazole, 4,5-dihydro-2-(2,3-dihydro-1,4-benzodioxin-2-yl)- AB00489883-09 BPBio1_000916 HMS2089E14 Idazoxane [French] NCGC00015560-04 NCGC00024794-04 SPBio_003011 Tox21_110173_1 2-(2,3-dihydro-1,4-benzodioxin-3-yl)-4,5-dihydro-1H-imidazole AC1L1H1U BSPBio_000832 DSSTox_CID_25161 idasoxan Idazoxanum NCGC00015560-08 Prestwick2_000926 (+-)-2-(1,4-Benzodioxan-2-yl)-2-imidazoline 79944-58-4 API0007263 CCG-204739 DTXSID6045161 Idazoxan [INN:BAN] Lopac0_000652 NCGC00015560-12 SBI-0050632.P002 Tox21 110173 2-(1,4-benzodioxan-2-yl)imidazoline AB00489883_10 BRD-A18696154-003-03-6 CHEMBL10316 HPMRFMKYPGXPEP-UHFFFAOYSA-N Idazoxano NCGC00015560-05 Prestwick0_000926 US8633208, Idazoxan 4,5-dihydro-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-1H-imidazole AKOS015915004 C10968 DSSTox_GSID_45161 Idazoxanum [Latin] NCGC00015560-09 Prestwick3_000926 A839791 BDBM50019848 CHEBI:5862 FT-0655996 Idazoxane LS-78447 NCGC00024794-03 SCHEMBL114731 [ Show all ]
Inchi Key	HPMRFMKYPGXPEP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C11H12N2O2/c1-2-4-9-8(3-1)14-7-10(15-9)11-12-5-6-13-11/h1-4,10H,5-7H2,(H,12,13)
PubChem CID	54459
ChEMBL	CHEMBL10316
IUPHAR	N/A
BindingDB	50019848
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Antagonist potency	1.0 -	PMID6133953	ChEMBL

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