BDBM50288985 (S)-2-{4-[(2,7-Dimethyl-4-oxo-3,4-dihydro-quinazolin-6-ylmethyl)-prop-2-ynyl-amino]-2-fluoro-benzoylamino}-4-[(S)-1-(1H-tetrazol-5-yl)-ethylcarbamoyl]-butyric acid::CHEMBL157025

SMILES C#CCN(Cc1cc2c(=O)[nH]c(C)nc2cc1C)c1ccc(C(=O)N[C@@H](CCC(=O)N[C@@H](C)c2nnn[nH]2)C(=O)O)c(F)c1

InChI Key InChIKey=XPWJYJITPLJYMI-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 = 50288985   

TargetThymidylate synthase(Mouse)
TBA

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50288985BDBM50288985((S)-2-{4-[(2,7-Dimethyl-4-oxo-3,4-dihydro-quinazol...)
Affinity DataIC50: 1nMAssay Description:Compound was evaluated for the inhibition of Thymidylate synthase.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2010
Entry Details Article