BDBM38551 3-(4-morpholin-4-ylbut-2-ynyl)-5-pentyloxolan-2-one;oxalic acid::3-[4-(4-morpholinyl)but-2-ynyl]-5-pentyl-2-oxolanone;oxalic acid::5-amyl-3-(4-morpholinobut-2-ynyl)tetrahydrofuran-2-one;oxalic acid::MLS000080189::SMR000036694::cid_657400::ethanedioic acid;3-(4-morpholin-4-ylbut-2-ynyl)-5-pentyl-oxolan-2-one

SMILES CCCCCC1CC(CC#CCN2CCOCC2)C(=O)O1

InChI Key InChIKey=QAANQFFTQRKOJX-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 = 38551   

TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38551(ethanedioic acid;3-(4-morpholin-4-ylbut-2-ynyl)-5-...)
Affinity DataIC50: 2.13E+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
LigandPNGBDBM38551(ethanedioic acid;3-(4-morpholin-4-ylbut-2-ynyl)-5-...)
Affinity DataIC50: 3.69E+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
LigandPNGBDBM38551(ethanedioic acid;3-(4-morpholin-4-ylbut-2-ynyl)-5-...)
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