BDBM45373 2-[(1-adamantylacetyl)amino]-3-methylbutanoic acid::2-[2-(1-adamantyl)ethanoylamino]-3-methyl-butanoic acid::2-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-methylbutanoic acid::2-[[2-(1-adamantyl)acetyl]amino]-3-methyl-butyric acid::2-[[2-(1-adamantyl)acetyl]amino]-3-methylbutanoic acid::MLS000090153::SMR000024770::cid_3241135

SMILES CC(C)C(NC(=O)CC12CC3CC(CC(C3)C1)C2)C(=O)O

InChI Key InChIKey=PEOFRASVOPVXDK-UHFFFAOYSA-N

Data  1 IC50

  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 = 45373   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45373BDBM45373(2-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-methylbuta...)
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