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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.
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Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	5-hydroxytryptamine receptor 2A
Species	Mus musculus (Mouse)
Gene	Htr2a
Synonym	serotonin 5HT-2 receptor 5Ht-2 'D' receptor 5-hydroxytryptamine (serotonin) receptor 2A, G protein-coupled 5-HT2A receptor 5-HT-2A 5-HT-2 Serotonin receptor 2A [ Show all ]
Disease	N/A for non-human GPCRs
Length	471
Amino acid sequence	MEILCEDNISLSSIPNSLMQLGDDSRLYPNDFNSRDANTSEASNWTIDAENRTNLSCEGYLPPTCLSILHLQEKNWSALLTTVVIILTIAGNILVIMAVSLEKKLQNATNYFLMSLAIADMLLGFLVMPVSMLTILYGYRWPLPSKLCAVWIYLDVLFSTASIMHLCAISLDRYVAIQNPIHHSRFNSRTKAFLKIIAVWTISVGISMPIPVFGLQDDSKVFKEGSCLLADDNFVLIGSFVAFFIPLTIMVITYFLTIKSLQKEATLCVSDLSTRAKLSSFSFLPQSSLSSEKLFQRSIHREPGSYAGRRTMQSISNEQKACKVLGIVFFLFVVMWCPFFITNIMAVICKESCNENVIGALLNVFVWIGYLSSAVNPLVYTLFNKTYRSAFSRYIQCQYKENRKPLQLILVNTIPTLAYKSSQLQVGQKKNSQEDAEPTANDCSMVTLGNQHSEEMCTDNIETVNEKVSCV
UniProt	P35363
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	CHEMBL5377
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	(-)-Quinpirole hydrochloride
Molecular formula	C13H22ClN3
IUPAC name	(4aR,8aR)-5-propyl-1,4,4a,6,7,8,8a,9-octahydropyrazolo[3,4-g]quinoline;hydrochloride
Molecular weight	255.79
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	None
Synonyms	(4aR-trans)-4,4a,5,6,7,8,8a,9-Octahydro-5-propyl-1H-pyrazolo[3,4-g]quinoline hydrochloride AKOS024456359 CHEMBL1256574 DTXSID8045519 LY-171555 NCGC00261675-01 SR-01000075397 trans-( C)-(4aR)-4,4a,5,6,7,8,8a,9-Octahydro-5-propyl-1H-pyrazolo[3,4-g]quinoline monohydrochloride 1H-Pyrazolo(3,4-g)quinolone, 4,4a,5,6,7,8,8a,9-octahydro-5-propyl-, monohydrochloride,(4aR-trans)- API0008813 D00YAS HY-B1752A MLS002222194 QUINPIROLE HYDROCHLORIDE SR-01000597925-1 (4aR,8aR)-5-propyl-1,4,4a,6,7,8,8a,9-octahydropyrazolo[3,4-g]quinoline hydrochloride 85798-08-9 CCG-222294 DSSTox_GSID_45519 LY 171555 NCGC00016954-05 SCHEMBL121129 Tox21_110707_1 ( C)-Quinpirole monohydrochloride (?)-Quinpirole hydrochloride AKOS030530543 CS-0013777 EU-0100990 LY171555 Q-102 SR-01000075397-1 UNII-T6I2W5V2K1 (-)-Quinpirole hydrochloride, >=98% (HPLC), solid 4,4a,5,6,7,8,8a,9-octahydro-5-propyl-1H-pyrzolo(3,4-g)quinoline C13H21N3.HCl D05682 LP00990 MolPort-003-666-734 Quinpirole hydrochloride (USAN) T6I2W5V2K1 (4AR,8aR)-5-propyl-4,4a,5,6,7,8,8a,9-octahydro-1H-pyrazolo[3,4-g]quinoline hydrochloride AC1L1IZP DSSTox_RID_80926 LY-171,555 NCGC00016954-10 SMR000326933 Tox21_500990 (-)-(4aR,8aR)-4,4a,5,6,7,8,8a,9-Octahydro-5-propyl-1H-pyrazolo(3,4-g)quinoline monohydrochloride 1H-Pyrazolo(3,4-g)quinoline, 4,4a,5,6,7,8,8a,9-octahydro-5-propyl-, monohydrochloride, (4aR-trans)- AOB5029 CTK8F1419 HMS1571K08 MLS000860075 Quinpirole HCl SR-01000597925 (-)quinpi-role hydrochloride 85760-74-3 CAS-85798-08-9 DSSTox_CID_25519 LS-129351 MolPort-003-959-422 Quinpirole hydrochloride [USAN] Tox21_110707 [ Show all ]
Inchi Key	HJHVRVJTYPKTHX-HTMVYDOJSA-N
Inchi ID	InChI=1S/C13H21N3.ClH/c1-2-5-16-6-3-4-10-7-12-11(8-13(10)16)9-14-15-12;/h9-10,13H,2-8H2,1H3,(H,14,15);1H/t10-,13-;/m1./s1
PubChem CID	55397
ChEMBL	CHEMBL1256574
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	Partition coefficient log P of this ligand is not available.

Experimental Data

Parameter	Value	Reference	Database source
EC50	24.42 nM	PubChem BioAssay data set	ChEMBL

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