BDBM50014509 (S)-2-(4-(((2-methyl-4-oxo-3,4-dihydroquinazolin-6-yl)methyl)(prop-2-ynyl)amino)-2-nitrobenzamido)pentanedioic acid::2-{4-[(2-Methyl-4-oxo-3,4-dihydro-quinazolin-6-ylmethyl)-prop-2-ynyl-amino]-2-nitro-benzoylamino}-pentanedioic acid::CHEMBL320464

SMILES Cc1nc2ccc(CN(CC#C)c3ccc(C(=O)NC(CCC(O)=O)C(O)=O)c(c3)[N+]([O-])=O)cc2c(=[OH+])[n-]1

InChI Key InChIKey=WIBBKABYNLZQSB-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 = 50014509   

TargetThymidylate synthase(Mouse)
Ici Pharmaceuticals Group

Curated by ChEMBL
LigandPNGBDBM50014509(CHEMBL320464 | 2-{4-[(2-Methyl-4-oxo-3,4-dihydro-q...)
Affinity DataIC50: 130nMAssay Description:Inhibition of partially purified thymidylate synthase (TS)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed