BDBM56670 1-[3-(3-chlorophenyl)-1-methyl-1H-pyrazol-4-yl]-N-(isoxazol-3-ylmethyl)-N-methylmethanamine::MLS000732676::N-[[3-(3-chlorophenyl)-1-methyl-4-pyrazolyl]methyl]-1-(3-isoxazolyl)-N-methylmethanamine::N-[[3-(3-chlorophenyl)-1-methyl-pyrazol-4-yl]methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanamine::N-[[3-(3-chlorophenyl)-1-methylpyrazol-4-yl]methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanamine::SMR000318561::[3-(3-chlorophenyl)-1-methyl-pyrazol-4-yl]methyl-(isoxazol-3-ylmethyl)-methyl-amine::cid_16192300

SMILES CN(Cc1ccon1)Cc1cn(C)nc1-c1cccc(Cl)c1

InChI Key InChIKey=PSHAZEOOQZRSFP-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 = 56670   

TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM56670(SMR000318561 | MLS000732676 | cid_16192300 | N-[[3...)
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