BDBM30653 1,3-Dimethyl-7-(4-methyl-benzyl)-8-(pyridin-3-ylmethylsulfanyl)-3,7-dihydro-purine-2,6-dione::1,3-dimethyl-7-(4-methylbenzyl)-8-(3-pyridylmethylthio)xanthine::1,3-dimethyl-7-[(4-methylphenyl)methyl]-8-(3-pyridinylmethylthio)purine-2,6-dione::1,3-dimethyl-7-[(4-methylphenyl)methyl]-8-(pyridin-3-ylmethylsulfanyl)purine-2,6-dione::MLS000035875::SMR000003393::cid_644657

SMILES Cc1ccc(Cn2c(SCc3cccnc3)nc3n(C)c(=O)n(C)c(=O)c23)cc1

InChI Key InChIKey=DYHHQCNOACMWNL-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 30653   

Target5-hydroxytryptamine receptor 1A(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM30653(1,3-Dimethyl-7-(4-methyl-benzyl)-8-(pyridin-3-ylme...)
Affinity DataEC50:  9.90E+4nMpH: 7.4 T: 2°CAssay Description:A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/14/2009
Entry Details
PCBioAssay