BDBM50049287 CHEMBL159633::N-(3-Nitro-benzyl)-4-{[4-oxo-2-(pyrimidin-2-ylsulfanylmethyl)-3,4-dihydro-quinazolin-6-ylmethyl]-prop-2-ynyl-amino}-benzamide

SMILES [O-][N+](=O)c1cccc(CNC(=O)c2ccc(cc2)N(CC#C)Cc2ccc3nc(CSc4ncccn4)[nH]c(=O)c3c2)c1

InChI Key InChIKey=KEONTDPDLYEZNG-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 = 50049287   

TargetThymidylate synthase(Mus musculus)
Zeneca Pharma

Curated by ChEMBL
LigandPNGBDBM50049287(CHEMBL159633 | N-(3-Nitro-benzyl)-4-{[4-oxo-2-(pyr...)
Affinity DataIC50:  480nMAssay Description:In vitro inhibitory activity against thymidylate synthase partially purified from L1210 mouse leukemia cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed