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GLASS

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

Name	5-hydroxytryptamine receptor 2A
Species	Rattus norvegicus (Rat)
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	MEILCEDNISLSSIPNSLMQLGDGPRLYHNDFNSRDANTSEASNWTIDAENRTNLSCEGYLPPTCLSILHLQEKNWSALLTTVVIILTIAGNILVIMAVSLEKKLQNATNYFLMSLAIADMLLGFLVMPVSMLTILYGYRWPLPSKLCAIWIYLDVLFSTASIMHLCAISLDRYVAIQNPIHHSRFNSRTKAFLKIIAVWTISVGISMPIPVFGLQDDSKVFKEGSCLLADDNFVLIGSFVAFFIPLTIMVITYFLTIKSLQKEATLCVSDLSTRAKLASFSFLPQSSLSSEKLFQRSIHREPGSYAGRRTMQSISNEQKACKVLGIVFFLFVVMWCPFFITNIMAVICKESCNENVIGALLNVFVWIGYLSSAVNPLVYTLFNKTYRSAFSRYIQCQYKENRKPLQLILVNTIPALAYKSSQLQVGQKKNSQEDAEQTVDDCSMVTLGKQQSEENCTDNIETVNEKVSCV
UniProt	P14842
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	CHEMBL322
IUPHAR	6
DrugBank	N/A

Ligand

Name	CHEMBL295689
Molecular formula	C13H16N4O
IUPAC name	4-(furan-2-yl)-2-(4-methylpiperazin-1-yl)pyrimidine
Molecular weight	244.298
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	1.2
Synonyms	1-[4-(2-Furanyl)pyrimidin-2-yl]-4-methylpiperazine BDBM50289604 4-Furan-2-yl-2-(4-methyl-piperazin-1-yl)-pyrimidine
Inchi Key	AFRJNNKMRAFXSE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C13H16N4O/c1-16-6-8-17(9-7-16)13-14-5-4-11(15-13)12-3-2-10-18-12/h2-5,10H,6-9H2,1H3
PubChem CID	10444523
ChEMBL	CHEMBL295689
IUPHAR	N/A
BindingDB	50289604
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	741.31 nM	PMID10821703	ChEMBL
Ki	745.0 nM	, Bioorg. Med. Chem. Lett., (1997) 7:13:1635	BindingDB,ChEMBL

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