BDBM50017081 2-{4-[(4-Oxo-2-trifluoromethyl-3,4-dihydro-quinazolin-6-ylmethyl)-prop-2-ynyl-amino]-benzoylamino}-pentanedioic acid::CHEMBL24599

SMILES OC(=O)CCC(NC(=O)c1ccc(cc1)N(CC#C)Cc1ccc2nc([nH]c(=O)c2c1)C(F)(F)F)C(O)=O

InChI Key InChIKey=JAIAMKVLKOZGKS-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 = 50017081   

TargetThymidylate synthase(Human)
University of South Alabama

Curated by ChEMBL
LigandPNGBDBM50017081(CHEMBL24599 | 2-{4-[(4-Oxo-2-trifluoromethyl-3,4-d...)
Affinity DataIC50: 5.70E+3nMAssay Description:Inhibition of purified human thymidylate synthase from a SV40-transformed human fibroblast cell line cloned in Escherichia coliMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed