BDBM45402 MLS000066135::N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-methylsulfanyl-ethanamide::N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(methylthio)acetamide::N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylthio)acetamide::N-(4-chloro-2-methoxy-5-methylphenyl)-2-methylsulfanylacetamide::SMR000079688::cid_734363

SMILES COc1cc(Cl)c(C)cc1NC(=O)CSC

InChI Key InChIKey=VAPBMRQMZKGJIW-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 = 45402   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45402BDBM45402(N-(4-chloro-2-methoxy-5-methylphenyl)-2-methylsulf...)
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