BDBM45518 2-Chloro-N-[(4-chloro-3-nitro-phenylcarbamoyl)-methyl]-N-cyclohexyl-benzamide::2-chloranyl-N-[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-N-cyclohexyl-benzamide::2-chloro-N-[2-(4-chloro-3-nitro-anilino)-2-keto-ethyl]-N-cyclohexyl-benzamide::2-chloro-N-[2-(4-chloro-3-nitroanilino)-2-oxoethyl]-N-cyclohexylbenzamide::MLS000551159::SMR000176709::cid_1117368

SMILES [O-][N+](=O)c1cc(NC(=O)CN(C2CCCCC2)C(=O)c2ccccc2Cl)ccc1Cl

InChI Key InChIKey=MWXFTOXDRVAKHI-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 45518   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45518BDBM45518(2-Chloro-N-[(4-chloro-3-nitro-phenylcarbamoyl)-met...)
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