BDBM45381 3-(3,4-dimethoxyphenyl)-N-(4-methylphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide::3-(3,4-dimethoxyphenyl)-N-(4-methylphenyl)-4,5-dihydroisoxazole-5-carboxamide::3-(3,4-dimethoxyphenyl)-N-(p-tolyl)-2-isoxazoline-5-carboxamide::MLS000092722::SMR000028413::cid_3245417

SMILES COc1ccc(cc1OC)C1=NOC(C1)C(=O)Nc1ccc(C)cc1

InChI Key InChIKey=UOLVMVHBQGMZDW-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 = 45381   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45381BDBM45381(3-(3,4-dimethoxyphenyl)-N-(4-methylphenyl)-4,5-dih...)
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