BDBM32963 MLS001002654::N-[3-(1-azepanylsulfonyl)phenyl]-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide::N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(1,4-diketo-3H-phthalazin-2-yl)acetamide::N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide::N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanamide::SMR000369234::cid_4836011

SMILES O=C(Cn1[nH]c(=O)c2ccccc2c1=O)Nc1cccc(S(=O)(=O)N2CCCCCC2)c1

InChI Key InChIKey=XCXPNLPYOJCKNH-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 32963   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 32963BDBM32963(SMR000369234 | MLS001002654 | cid_4836011 | 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:
5/27/2011
Entry Details
PCBioAssay
TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 32963BDBM32963(SMR000369234 | MLS001002654 | cid_4836011 | N-[3-(...)
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