BDBM56082 2-[[2-[3-(4-fluorophenyl)-7-keto-triazolo[4,5-d]pyrimidin-6-yl]acetyl]amino]acetic acid ethyl ester::2-[[2-[3-(4-fluorophenyl)-7-oxo-6-triazolo[4,5-d]pyrimidinyl]-1-oxoethyl]amino]acetic acid ethyl ester::MLS000092814::SMR000028463::cid_3239024::ethyl 2-[2-[3-(4-fluorophenyl)-7-oxidanylidene-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]ethanoylamino]ethanoate::ethyl 2-[[2-[3-(4-fluorophenyl)-7-oxotriazolo[4,5-d]pyrimidin-6-yl]acetyl]amino]acetate::ethyl N-{[3-(4-fluorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetyl}glycinate

SMILES CCOC(=O)CNC(=O)Cn1cnc2n(nnc2c1=O)-c1ccc(F)cc1

InChI Key InChIKey=AAVZGVSVAPWVHJ-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 56082   

TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM56082(ethyl 2-[[2-[3-(4-fluorophenyl)-7-oxotriazolo[4,5-...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/8/2011
Entry Details
PCBioAssay