BDBM66104 4-ethyl-5-hydroxy-7-methyl-6-(1-pyrrolidinylmethyl)-1-benzopyran-2-one::4-ethyl-5-hydroxy-7-methyl-6-(pyrrolidin-1-ylmethyl)chromen-2-one::4-ethyl-5-hydroxy-7-methyl-6-(pyrrolidinomethyl)coumarin::4-ethyl-7-methyl-5-oxidanyl-6-(pyrrolidin-1-ylmethyl)chromen-2-one::MLS000081527::SMR000043781::cid_5389615

SMILES CCc1cc(=O)oc2cc(C)c(CN3CCCC3)c(O)c12

InChI Key InChIKey=DDDYTXIDUOUJBD-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 = 66104   

TargetBeta-lactamase(Pseudomonas aeruginosa)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM66104(4-ethyl-5-hydroxy-7-methyl-6-(1-pyrrolidinylmethyl...)
Affinity DataIC50: 6.96E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2011
Entry Details
PCBioAssay
TargetBeta-lactamase(Salmonella enterica subsp. enterica serovar Choler...)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM66104(4-ethyl-5-hydroxy-7-methyl-6-(1-pyrrolidinylmethyl...)
Affinity DataIC50: 5.96E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2011
Entry Details
PCBioAssay
TargetBeta-lactamase(Pseudomonas aeruginosa)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM66104(4-ethyl-5-hydroxy-7-methyl-6-(1-pyrrolidinylmethyl...)
Affinity DataIC50: 5.96E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2011
Entry Details
PCBioAssay