BDBM45733 MLS000830806::N-(2-furanylmethyl)-2,3-dihydrobenzofuran-5-carboxamide::N-(2-furfuryl)coumaran-5-carboxamide::N-(2-furylmethyl)-2,3-dihydro-1-benzofuran-5-carboxamide::N-(furan-2-ylmethyl)-2,3-dihydro-1-benzofuran-5-carboxamide::SMR000458227::cid_2810990

SMILES O=C(NCc1ccco1)c1ccc2OCCc2c1

InChI Key InChIKey=XNWAMFICMGJADL-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 = 45733   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45733BDBM45733(SMR000458227 | cid_2810990 | N-(furan-2-ylmethyl)-...)
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
TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45733BDBM45733(SMR000458227 | cid_2810990 | N-(furan-2-ylmethyl)-...)
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