BDBM50049272 2-Fluoro-4-{[7-methyl-2-(4-methyl-piperazin-1-ylmethyl)-4-oxo-3,4-dihydro-quinazolin-6-ylmethyl]-prop-2-ynyl-amino}-N-(3-nitro-benzyl)-benzamide::CHEMBL161033

SMILES CN1CCN(Cc2nc3cc(C)c(CN(CC#C)c4ccc(C(=O)NCc5cccc(c5)[N+]([O-])=O)c(F)c4)cc3c(=O)[nH]2)CC1

InChI Key InChIKey=YKYGLROYAXGHKK-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 = 50049272   

TargetThymidylate synthase(Mus musculus)
Zeneca Pharma

Curated by ChEMBL
LigandPNGBDBM50049272(2-Fluoro-4-{[7-methyl-2-(4-methyl-piperazin-1-ylme...)
Affinity DataIC50:  110nMAssay Description:In vitro inhibitory activity against thymidylate synthase partially purified from L1210 mouse leukemia cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed