BDBM66405 MLS000572983::N-(3-chloranyl-4-methyl-phenyl)-3-nitro-4-(oxolan-2-ylmethylamino)benzamide::N-(3-chloro-4-methyl-phenyl)-3-nitro-4-(tetrahydrofurfurylamino)benzamide::N-(3-chloro-4-methylphenyl)-3-nitro-4-(2-oxolanylmethylamino)benzamide::N-(3-chloro-4-methylphenyl)-3-nitro-4-(oxolan-2-ylmethylamino)benzamide::N-(3-chloro-4-methylphenyl)-3-nitro-4-[(tetrahydro-2-furanylmethyl)amino]benzamide::SMR000195291::cid_2900569

SMILES Cc1ccc(NC(=O)c2ccc(NCC3CCCO3)c(c2)[N+]([O-])=O)cc1Cl

InChI Key InChIKey=QVAVAXFGIGDMCS-UHFFFAOYSA-N

Data  1 IC50  3 EC50

  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 4 hits for monomerid = 66405   

TargetArf-GAP with SH3 domain, ANK repeat and PH domain-containing protein 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM66405(N-(3-chloro-4-methylphenyl)-3-nitro-4-(2-oxolanylm...)
Affinity DataIC50: 5.20E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2013
Entry Details
PCBioAssay
TargetEndoribonuclease toxin MazF(Escherichia coli (strain K12))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM66405(N-(3-chloro-4-methylphenyl)-3-nitro-4-(2-oxolanylm...)
Affinity DataEC50: >9.90E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2012
Entry Details
PCBioAssay
TargetEndoribonuclease toxin MazF(Escherichia coli (strain K12))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM66405(N-(3-chloro-4-methylphenyl)-3-nitro-4-(2-oxolanylm...)
Affinity DataEC50: >9.90E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2012
Entry Details
PCBioAssay
TargetBcl-2-like protein 11(Human)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM66405(N-(3-chloro-4-methylphenyl)-3-nitro-4-(2-oxolanylm...)
Affinity DataEC50:  2.20E+5nMAssay Description:Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2011
Entry Details
PCBioAssay