BDBM45343 (6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)methylene-(1,2,4-triazol-4-yl)amine::1-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)-N-(1,2,4-triazol-4-yl)methanimine::MLS000055535::SMR000066044::cid_2998143

SMILES CC1(C)C2CC=C(C=Nn3cnnc3)C1C2

InChI Key InChIKey=XXGDBFBBQLDWKK-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 = 45343   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45343BDBM45343(SMR000066044 | MLS000055535 | cid_2998143 | 1-(6,6...)
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