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GLASS

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

Name	Alpha-2A adrenergic receptor
Species	Mus musculus (Mouse)
Gene	Adra2a
Synonym	alpha2D alpha2A-AR alpha2A-adrenoceptor alpha2A-adrenergic receptor alpha2A Alpha-2AAR Alpha-2A adrenoreceptor Alpha-2A adrenoceptor adrenergic receptor Adrenergic alpha 2A receptor ADRA2R ADRA2 Adra-2a Adra-2 [ Show all ]
Disease	N/A for non-human GPCRs
Length	450
Amino acid sequence	MGSLQPDAGNSSWNGTEAPGGGTRATPYSLQVTLTLVCLAGLLMLFTVFGNVLVIIAVFTSRALKAPQNLFLVSLASADILVATLVIPFSLANEVMGYWYFGKVWCEIYLALDVLFCTSSIVHLCAISLDRYWSITQAIEYNLKRTPRRIKAIIVTVWVISAVISFPPLISIEKKGAGGGQQPAEPSCKINDQKWYVISSSIGSFFAPCLIMILVYVRIYQIAKRRTRVPPSRRGPDACSAPPGGADRRPNGLGPERGAGPTGAEAEPLPTQLNGAPGEPAPAGPRDGDALDLEESSSSEHAERPPGPRRPDRGPRAKGKTRASQVKPGDSLPRRGPGAAGPGASGSGHGEERGGGAKASRWRGRQNREKRFTFVLAVVIGVFVVCWFPFFFTYTLIAVGCPVPSQLFNFFFWFGYCNSSLNPVIYTIFNHDFRRAFKKILCRGDRKRIV
UniProt	Q01338
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	CHEMBL4075
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	ST 91
Molecular formula	C13H19N3
IUPAC name	N-(2,6-diethylphenyl)-4,5-dihydro-1H-imidazol-2-amine
Molecular weight	217.316
Hydrogen bond acceptor	1
Hydrogen bond donor	2
XlogP	2.3
Synonyms	ZINC13476057 747353-31-7 CAS_4749-61-5 N-(2,6-Diethylphenyl)-4,5-dihydro-1H-imidazol-2-amine 2-(2,6-Diethylphenylamino)-2-imidazolidine AKOS030582715 CTK5E0419 SCHEMBL4762027 U94VU1Q8HC 4749-61-5 (mono-hydrochloride) BRD-K18905250-003-01-6 FT-0765429 CHEBI:92344 NC-5 2-(2,6-diethylphenylamino)-2-imidazoline BDBM85235 DA-42362 UNII-U94VU1Q8HC 4751-48-8 C13H19N3 LS-175054 2-(2,6-diethylphenyl)iminoimidazolidine AC1L2H5I CHEMBL301717 NCGC00167806-01 ST-91 4749-61-5 Benzenamine,2,6-diethyl-N-2-imidazolidinylidene- DTXSID50197171 [ Show all ]
Inchi Key	IALHTUPVRAQZFI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C13H19N3/c1-3-10-6-5-7-11(4-2)12(10)16-13-14-8-9-15-13/h5-7H,3-4,8-9H2,1-2H3,(H2,14,15,16)
PubChem CID	20864
ChEMBL	N/A
IUPHAR	N/A
BindingDB	85235
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	537.03 nM	PMID9605427	BindingDB

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