BDBM50152938 4-[4-(2-fluoro-5-methoxybenzyl)hexahydro-1-pyrazinyl]spiro[cyclohexane-1,7''-(2'',3'',7'',9''-tetrahydro[1,4]dioxino[3,2-e]isobenzofuran)]-9''-one::CHEMBL361836

SMILES COc1ccc(F)c(CC2CCN(CC2)[C@H]2CC[C@]3(CC2)OC(=O)c2c3ccc3OCCOc23)c1

InChI Key InChIKey=IQKZRRCOYZUDHR-UHFFFAOYSA-N

Data  1 IC50

  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 = 50152938   

TargetSodium-dependent serotonin transporter(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50152938(4-[4-(2-fluoro-5-methoxybenzyl)hexahydro-1-pyrazin...)
Affinity DataIC50: 430nMAssay Description:Inhibitory activity against human- serotonin reuptake transmitter using [3H]-citalopram as a radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed