BDBM45344 (2Z)-3-keto-4-[4-(2-methoxyphenyl)piperazino]-2-(4-phenyl-4-thiazolin-2-ylidene)butyronitrile::(2Z)-4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-oxo-2-(4-phenyl-3H-thiazol-2-ylidene)butanenitrile::(2Z)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-2-(4-phenyl-3H-1,3-thiazol-2-ylidene)butanenitrile::(2Z)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxo-2-(4-phenyl-3H-1,3-thiazol-2-ylidene)butanenitrile::MLS000055217::SMR000065605::cid_5665572

SMILES COc1ccccc1N1CCN(CC(=O)C(C#N)c2nc(cs2)-c2ccccc2)CC1

InChI Key InChIKey=CLASRALGMQXCAR-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 = 45344   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45344BDBM45344((2Z)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxida...)
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:
5/27/2011
Entry Details
PCBioAssay