BDBM45651 (6-methyl-3-nitro-2-oxidanylidene-1H-pyridin-4-yl) (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate::(6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate::(E)-3-(3,4-dimethoxyphenyl)-2-propenoic acid (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) ester::(E)-3-(3,4-dimethoxyphenyl)acrylic acid (2-keto-6-methyl-3-nitro-1H-pyridin-4-yl) ester::MLS000685020::SMR000324736::cid_7150694

SMILES COc1ccc(\C=C\C(=O)Oc2cc(C)[nH]c(=O)c2[N+]([O-])=O)cc1OC

InChI Key InChIKey=MGGHACFNPQGVFS-FNORWQNLSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 45651   

TargetCoagulation factor XII(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM45651((6-methyl-3-nitro-2-oxidanylidene-1H-pyridin-4-yl)...)
Affinity DataIC50:  49.5nMAssay 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 DepthDetails PCBioAssay