BDBM55943 MLS000033670::N-(2-Fluoro-benzyl)-N-{[(tetrahydro-furan-2-ylmethyl)-carbamoyl]-methyl}-2-(5-thiophen-2-yl-tetrazol-2-yl)-acetamide::N-(2-fluorobenzyl)-N-[2-keto-2-(tetrahydrofurfurylamino)ethyl]-2-[5-(2-thienyl)tetrazol-2-yl]acetamide::N-[(2-fluorophenyl)methyl]-N-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]-2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanamide::N-[(2-fluorophenyl)methyl]-N-[2-oxo-2-(2-oxolanylmethylamino)ethyl]-2-(5-thiophen-2-yl-2-tetrazolyl)acetamide::N-[(2-fluorophenyl)methyl]-N-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]-2-(5-thiophen-2-yltetrazol-2-yl)acetamide::SMR000003629::cid_644906

SMILES Fc1ccccc1CN(CC(=O)NCC1CCCO1)C(=O)Cn1nnc(n1)-c1cccs1

InChI Key InChIKey=KABPXOPMYUMHMH-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 = 55943   

TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM55943(cid_644906 | MLS000033670 | N-(2-Fluoro-benzyl)-N-...)
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:
6/8/2011
Entry Details
PCBioAssay