BDBM50051701 3-[Bis-(2-chloro-ethyl)-amino]-N-(2-dimethylamino-ethyl)-2,6-dinitro-benzamide::CHEMBL22212

SMILES CN(C)CCNC(=O)c1c(ccc(N(CCCl)CCCl)c1[N+]([O-])=O)[N+]([O-])=O

InChI Key InChIKey=PSFSTGUTQMCFOL-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50051701   

TargetNitroreductase NfsA(Escherichia coli (Enterobacteria))
Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50051701(3-[Bis-(2-chloro-ethyl)-amino]-N-(2-dimethylamino-...)
Affinity DataIC50: 8.95E+5nMAssay Description:Cytotoxicity in T79-A3 (NR-positive) cell linesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed