BDBM50049291 2-{4-[(2-Methyl-4-oxo-3,4-dihydro-quinazolin-6-ylmethyl)-prop-2-ynyl-amino]-benzoylamino}-3-(3-nitro-phenyl)-propionic acid::CHEMBL348765

SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NC(Cc3cccc(c3)[N+]([O-])=O)C(O)=O)cc2c(=O)[nH]1

InChI Key InChIKey=PHFQYPNLXHFERJ-UHFFFAOYSA-N

Data  1 IC50

  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 1 hit for monomerid = 50049291   

TargetThymidylate synthase(Mus musculus)
Zeneca Pharma

Curated by ChEMBL
LigandPNGBDBM50049291(2-{4-[(2-Methyl-4-oxo-3,4-dihydro-quinazolin-6-ylm...)
Affinity DataIC50:  10nMAssay Description:In vitro inhibitory activity against thymidylate synthase partially purified from L1210 mouse leukemia cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed