BDBM50049269 4-[(2-{[Bis-(2-hydroxy-ethyl)-amino]-methyl}-7-methyl-4-oxo-3,4-dihydro-quinazolin-6-ylmethyl)-prop-2-ynyl-amino]-2-fluoro-N-(3-nitro-benzyl)-benzamide::CHEMBL159584

SMILES Cc1cc2nc(CN(CCO)CCO)[nH]c(=O)c2cc1CN(CC#C)c1ccc(C(=O)NCc2cccc(c2)[N+]([O-])=O)c(F)c1

InChI Key InChIKey=AKLJBTJVORYKJL-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50049269   

TargetThymidylate synthase(Mus musculus)
Zeneca Pharma

Curated by ChEMBL
LigandPNGBDBM50049269(4-[(2-{[Bis-(2-hydroxy-ethyl)-amino]-methyl}-7-met...)
Affinity DataIC50:  160nMAssay Description:In vitro inhibitory activity against thymidylate synthase partially purified from L1210 mouse leukemia cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed