BDBM45715 3-(1-benzotriazolyl)-N-(1-thiophen-2-ylethylideneamino)propanamide::3-(benzotriazol-1-yl)-N-(1-thiophen-2-ylethylideneamino)propanamide::3-(benzotriazol-1-yl)-N-[1-(2-thienyl)ethylideneamino]propionamide::3-Benzotriazol-1-yl-propionic acid [1-thiophen-2-yl-eth-(E)-ylidene]-hydrazide::MLS000769289::SMR000434023::cid_742351

SMILES CC(=NNC(=O)CCn1nnc2ccccc12)c1cccs1

InChI Key InChIKey=LAEAICIHMHJQSL-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 = 45715   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45715BDBM45715(MLS000769289 | 3-Benzotriazol-1-yl-propionic acid ...)
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