BDBM38514 MLS000076301::N-(2,5-Diethoxy-phenyl)-2-[4-(2,3-dimethyl-phenyl)-piperazin-1-yl]-acetamide::N-(2,5-diethoxyphenyl)-2-[4-(2,3-dimethylphenyl)-1-piperazinyl]acetamide;hydrochloride::N-(2,5-diethoxyphenyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]acetamide;hydrochloride::N-(2,5-diethoxyphenyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanamide;hydrochloride::N-(2,5-diethoxyphenyl)-2-[4-(2,3-dimethylphenyl)piperazino]acetamide;hydrochloride::SMR000008357::cid_6603085

SMILES CCOc1ccc(OCC)c(NC(=O)CN2CCN(CC2)c2cccc(C)c2C)c1

InChI Key InChIKey=NLWMPZFCNPTDII-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 = 38514   

TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38514(SMR000008357 | MLS000076301 | N-(2,5-diethoxypheny...)
Affinity DataIC50: 4.34E+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
LigandPNGBDBM38514(SMR000008357 | MLS000076301 | N-(2,5-diethoxypheny...)
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
TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38514(SMR000008357 | MLS000076301 | N-(2,5-diethoxypheny...)
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