BDBM38598 MLS000047956::N-methyl-2-(2-pyridinyl)-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamine;oxalic acid::N-methyl-2-pyridin-2-yl-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamine;oxalic acid::N-methyl-N-(2-pyridin-2-ylethyl)-N-(3,4,5-trimethoxybenzyl)amine::SMR000033954::cid_3239286::ethanedioic acid;N-methyl-2-pyridin-2-yl-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamine::methyl-[2-(2-pyridyl)ethyl]-(3,4,5-trimethoxybenzyl)amine;oxalic acid

SMILES COc1cc(CN(C)CCc2ccccn2)cc(OC)c1OC

InChI Key InChIKey=NWXASCBITHSPTM-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 38598   

TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38598(cid_3239286 | SMR000033954 | MLS000047956 | N-meth...)
Affinity DataIC50: 1.01E+5nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2011
Entry Details
PCBioAssay
TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38598(cid_3239286 | SMR000033954 | MLS000047956 | N-meth...)
Affinity DataIC50: 1.90E+5nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/30/2011
Entry Details
PCBioAssay
TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38598(cid_3239286 | SMR000033954 | MLS000047956 | N-meth...)
Affinity DataIC50: 1.00E+7nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2011
Entry Details
PCBioAssay