BDBM45422 MLS000103204::N-[3-(1,3-benzothiazol-2-yl)-6-ethanoyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]cyclopropanecarboxamide::N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]cyclopropanecarboxamide::SMR000018639::cid_3703459

SMILES CC(=O)N1CCc2c(C1)sc(NC(=O)C1CC1)c2-c1nc2ccccc2s1

InChI Key InChIKey=XSUNHXBHUIAZQE-UHFFFAOYSA-N

Data  1 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 = 45422   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45422BDBM45422(MLS000103204 | cid_3703459 | N-[3-(1,3-benzothiazo...)
Affinity DataIC50: 2.57E+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