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GLASS

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GPCR

Name	D(3) dopamine receptor
Species	Homo sapiens (Human)
Gene	DRD3
Synonym	dopaminergic receptor D3 D3R D3 receptor dopamine D3 receptor
Disease	Unspecified Emesis; Gastric motility disorder Female sexual dysfunction Male sexual disorders Psychotic disorders Cocaine addiction Schizophrenia Drug abuse [ Show all ]
Length	400
Amino acid sequence	MASLSQLSSHLNYTCGAENSTGASQARPHAYYALSYCALILAIVFGNGLVCMAVLKERALQTTTNYLVVSLAVADLLVATLVMPWVVYLEVTGGVWNFSRICCDVFVTLDVMMCTASILNLCAISIDRYTAVVMPVHYQHGTGQSSCRRVALMITAVWVLAFAVSCPLLFGFNTTGDPTVCSISNPDFVIYSSVVSFYLPFGVTVLVYARIYVVLKQRRRKRILTRQNSQCNSVRPGFPQQTLSPDPAHLELKRYYSICQDTALGGPGFQERGGELKREEKTRNSLSPTIAPKLSLEVRKLSNGRLSTSLKLGPLQPRGVPLREKKATQMVAIVLGAFIVCWLPFFLTHVLNTHCQTCHVSPELYSATTWLGYVNSALNPVIYTTFNIEFRKAFLKILSC
UniProt	P35462
Protein Data Bank	3pbl
GPCR-HGmod model	P35462
3D structure model	This structure is from PDB ID 3pbl.
BioLiP	BL0191566, BL0191567
Therapeutic Target Database	T02551
ChEMBL	CHEMBL234
IUPHAR	216
DrugBank	BE0000581

Ligand

Name	1-(5-bromothiophen-2-yl)-2-chloroethanone
Molecular formula	C6H4BrClOS
IUPAC name	1-(5-bromothiophen-2-yl)-2-chloroethanone
Molecular weight	239.511
Hydrogen bond acceptor	2
Hydrogen bond donor	0
XlogP	3.3
Synonyms	1-(5-bromo-thiophen-2-yl)-2-chloroethanone BC002930 Ethanone, 1-(5-bromo-2-thienyl)-2-chloro- STL280131 CHEMBL142764 KB-215359 1-(5-bromo-2-thiophenyl)-2-chloroethanone AC1MBVAG DB-073172 PubChem5287 1-(5-bromothiophen-2-yl)-2-chloro-ethanone BDBM7867 FT-0743197 ZINC2576038 (5-bromo-thiophen-2-yl)-2-chloro-ethanone 62673-67-0 Chloromethyl Thienyl Ketone deriv. 15 MCULE-6579649986 1-(5-Bromo-thiophen-2-yl)-2-chloro-ethanone AKOS010337421 DTXSID20373763 SCHEMBL3998532 1-(5-bromothiophen-2-yl)-2-chloroethan-1-one KB-147512 1-(5-bromanylthiophen-2-yl)-2-chloranyl-ethanone A833921 CTK2B4685 MolPort-000-152-430 [ Show all ]
Inchi Key	LLKNSKSZYVBKOO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C6H4BrClOS/c7-6-2-1-5(10-6)4(9)3-8/h1-2H,3H2
PubChem CID	2757188
ChEMBL	CHEMBL142764
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Inhibition	>10.0 %	PMID19747834	ChEMBL

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