BDBM45384 5-amino-1-(4-chlorobenzyl)-1H-pyrazole-4-carbonitrile::5-amino-1-(4-chlorobenzyl)pyrazole-4-carbonitrile::5-amino-1-[(4-chlorophenyl)methyl]-4-pyrazolecarbonitrile::5-amino-1-[(4-chlorophenyl)methyl]pyrazole-4-carbonitrile::5-azanyl-1-[(4-chlorophenyl)methyl]pyrazole-4-carbonitrile::MLS000061640::SMR000069971::cid_815333

SMILES Nc1c(cnn1Cc1ccc(Cl)cc1)C#N

InChI Key InChIKey=VPYBXOQUUAZRKG-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 45384   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45384BDBM45384(5-amino-1-[(4-chlorophenyl)methyl]-4-pyrazolecarbo...)
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