BDBM50262682 CHEMBL477572::N-(2-Methylsulfanyl-benzyl)-N-(S)-pyrrolidin-3-yl-methanesulfonamide

SMILES CSc1ccccc1CN([C@H]1CCNC1)S(C)(=O)=O

InChI Key InChIKey=BUJVJHVEEOZSIE-UHFFFAOYSA-N

Data  3 KI

  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 3 hits for monomerid = 50262682   

LigandPNGBDBM50262682(N-(2-Methylsulfanyl-benzyl)-N-(S)-pyrrolidin-3-yl-...)
Affinity DataKi:  86nMAssay Description:Inhibition of [3H]nisoxetine reuptake at human NET expressed in HEK293 cells by SPAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Pfizer

Curated by ChEMBL
LigandPNGBDBM50262682(N-(2-Methylsulfanyl-benzyl)-N-(S)-pyrrolidin-3-yl-...)
Affinity DataKi:  1.25E+3nMAssay Description:Inhibition of [3H]citalopram uptake at human 5HTT expressed in HEK293 cells by SPAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetSodium-dependent dopamine transporter(Human)
Pfizer

Curated by ChEMBL
LigandPNGBDBM50262682(N-(2-Methylsulfanyl-benzyl)-N-(S)-pyrrolidin-3-yl-...)
Affinity DataKi:  2.95E+3nMAssay Description:Inhibition of [3H]dopamine reuptake at human DAT expressed in HEK293 cells by SPAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed