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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	Alpha-2B adrenergic receptor
Species	Rattus norvegicus (Rat)
Gene	Adra2b
Synonym	ADRA2L1 alpha2B-adrenoceptor alpha2B alpha2-C2 alpha-2BAR alpha-2B adrenoreceptor Alpha-2B adrenoceptor Adra-2b adrenergic receptor Adrenergic alpha2B- receptor class III ADRA2RL1 alpha-2B adrenergic receptor [ Show all ]
Disease	N/A for non-human GPCRs
Length	453
Amino acid sequence	MSGPTMDHQEPYSVQATAAIASAITFLILFTIFGNALVILAVLTSRSLRAPQNLFLVSLAAADILVATLIIPFSLANELLGYWYFWRAWCEVYLALDVLFCTSSIVHLCAISLDRYWAVSRALEYNSKRTPRRIKCIILTVWLIAAVISLPPLIYKGDQRPEPRGLPQCELNQEAWYILASSIGSFFAPCLIMILVYLRIYVIAKRSHCRGLGAKRGSGEGESKKPQPVAGGVPTSAKVPTLVSPLSSVGEANGHPKPPREKEEGETPEDPEARALPPTWSALPRSGQGQKKGTSGATAEEGDEEDEEEVEECEPQTLPASPASVCNPPLQQPQTSRVLATLRGQVLLGKNVGVASGQWWRRRTQLSREKRFTFVLAVVIGVFVVCWFPFFFSYSLGAICPQHCKVPHGLFQFFFWIGYCNSSLNPVIYTVFNQDFRRAFRRILCRPWTQTGW
UniProt	P19328
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	CHEMBL266
IUPHAR	26
DrugBank	N/A

Ligand

Name	3600-87-1
Molecular formula	C10H15NO3
IUPAC name	2-amino-1-(2,5-dimethoxyphenyl)ethanol
Molecular weight	197.234
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	0.1
Synonyms	AC1Q4872 C21521 DESGLYMIDODRINE Orvaten Z380844680 2,5-Dimethoxy-beta-hydroxyphenethylamine 2-amino-1-(2',5'-dimethoxyphenyl)ethanol 600A871 alpha-(Aminomethyl)-2,5-dimethoxybenzenemethanol CHEMBL1076 KB-19462 ST 1059 (+-)-2-amino-1-(2,5-dimethoxyphenyl)ethanol 2-amino-1-(2,5-dimethoxyphenyl)ethanol AC1L29I0 Benzenemethanol, a-(aminomethyl)-2,5-dimethoxy- de-glymidodrine MolPort-001-793-604 TC-146150 1-(2',5'-dimethoxyphenyl)-2-aminoethanol 2-Amino-(2,5-dimethoxyphenyl)ethanol AKOS000123871 CHEBI:73248 EN300-36742 rac-2-amino-1-(2,5-dimethoxyphenyl)ethanol 2-Amino-1-(2,5-dimethoxy-phenyl)-ethanol 60407-53-6 (hydrochloride) ANW-57405 CTK4H5735 MCULE-6688431628 ST-1059 (+/-)-2-Amino-1-(2, 5 dimethoxyphenyl) ethanol 2-Amino-1-(2,5-dimethoxyphenyl)ethanol, AldrichCPR AC1Q4871 Benzyl alcohol, alpha-(aminomethyl)-2,5-dimethoxy- Deglymidodrine NE21743 VFRCNXKYZVQYLX-UHFFFAOYSA-N 1-(2',5'-Dimethoxyphenyl)aminoethanol 2-amino-1-(2',5'-dimethoxyphenyl) ethanol 52047-77-5 AKOS016842856 FT-0674660 SCHEMBL476432 2-amino-1-(2,5-dimethoxyphenyl)ethan-1-ol AB01002492-01 BDBM50118702 DB-027711 Midodrine Related Compound A (Desglymidodrine) ST50407701 (+/-)-2-amino-1-(2,5-dimethoxyphenyl)ethanol [ Show all ]
Inchi Key	VFRCNXKYZVQYLX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C10H15NO3/c1-13-7-3-4-10(14-2)8(5-7)9(12)6-11/h3-5,9,12H,6,11H2,1-2H3
PubChem CID	43260
ChEMBL	CHEMBL1076
IUPHAR	N/A
BindingDB	50118702
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	1862.09 nM	PMID15163201	ChEMBL

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