BDBM32722 (4-chlorophenyl)-[3-(2-furanyl)-5-(methylthio)-1,2,4-triazol-1-yl]methanone::(4-chlorophenyl)-[3-(2-furyl)-5-(methylthio)-1,2,4-triazol-1-yl]methanone::(4-chlorophenyl)-[3-(furan-2-yl)-5-methylsulfanyl-1,2,4-triazol-1-yl]methanone::MLS000522280::SMR000127548::cid_3586641

SMILES CSc1nc(nn1C(=O)c1ccc(Cl)cc1)-c1ccco1

InChI Key InChIKey=JBCIQOTXWVGRSP-UHFFFAOYSA-N

Data  5 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 32722   

TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32722(cid_3586641 | (4-chlorophenyl)-[3-(furan-2-yl)-5-m...)
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:
4/30/2011
Entry Details
PCBioAssay