BDBM32710 2-(4-methoxyphenyl)-N-piperonyl-acetamide::MLS000533605::N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)acetamide::N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)ethanamide::SMR000141043::cid_754514

SMILES COc1ccc(CC(=O)NCc2ccc3OCOc3c2)cc1

InChI Key InChIKey=NKCBBGROZYVNOY-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 32710   

TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 32710BDBM32710(cid_754514 | MLS000533605 | N-(1,3-benzodioxol-5-y...)
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:
4/30/2011
Entry Details
PCBioAssay
TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 32710BDBM32710(cid_754514 | MLS000533605 | N-(1,3-benzodioxol-5-y...)
Affinity DataIC50: 5.00E+4nMpH: 7.4 T: 2°CAssay Description:Factor XIa (0.23 ug/mL) was incubated with Boc-Glu-Ala-Arg-AMC substrate (15 uM) in 10 uL of assay buffer for 2 hr at room temperature. Read fluoresc...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/26/2009
Entry Details
PCBioAssay