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GLASS

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

Name	D(2) dopamine receptor
Species	Rattus norvegicus (Rat)
Gene	Drd2
Synonym	D2 receptor D2(415) and D₂₍₄₄₄₎ D2A and D_2B D2R Dopamine D2 receptor dopamine receptor 2 [ Show all ]
Disease	N/A for non-human GPCRs
Length	444
Amino acid sequence	MDPLNLSWYDDDLERQNWSRPFNGSEGKADRPHYNYYAMLLTLLIFIIVFGNVLVCMAVSREKALQTTTNYLIVSLAVADLLVATLVMPWVVYLEVVGEWKFSRIHCDIFVTLDVMMCTASILNLCAISIDRYTAVAMPMLYNTRYSSKRRVTVMIAIVWVLSFTISCPLLFGLNNTDQNECIIANPAFVVYSSIVSFYVPFIVTLLVYIKIYIVLRKRRKRVNTKRSSRAFRANLKTPLKGNCTHPEDMKLCTVIMKSNGSFPVNRRRMDAARRAQELEMEMLSSTSPPERTRYSPIPPSHHQLTLPDPSHHGLHSNPDSPAKPEKNGHAKIVNPRIAKFFEIQTMPNGKTRTSLKTMSRRKLSQQKEKKATQMLAIVLGVFIICWLPFFITHILNIHCDCNIPPVLYSAFTWLGYVNSAVNPIIYTTFNIEFRKAFMKILHC
UniProt	P61169
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	CHEMBL339
IUPHAR	215
DrugBank	N/A

Ligand

Name	CHEMBL41238
Molecular formula	C18H21NO2S
IUPAC name	(1S,10R)-14-propyl-15-thia-11-azatetracyclo[8.7.0.02,7.013,17]heptadeca-2,4,6,13,16-pentaene-4,5-diol
Molecular weight	315.431
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	3.4
Synonyms	(5aR,11bS)-3-Propyl-4,5,5a,6,7,11b-hexahydro-2-thia-5-aza-cyclopenta[c]phenanthrene-9,10-diol; TFA BDBM50057856 SCHEMBL7007392 3-Propyl-4,5,5abeta,6,7,11balpha-hexahydro-2-thia-5-aza-2H-cyclopenta[c]phenanthrene-9,10-diol CHEMBL1178784
Inchi Key	WDHPIPIHLLCKBB-KDOFPFPSSA-N
Inchi ID	InChI=1S/C18H21NO2S/c1-2-3-17-12-8-19-14-5-4-10-6-15(20)16(21)7-11(10)18(14)13(12)9-22-17/h6-7,9,14,18-21H,2-5,8H2,1H3/t14-,18+/m1/s1
PubChem CID	10519436
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50057856
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	100.0 nM	PMID9171869	BindingDB

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