BDBM32703 MLS000529568::Methyl-(3-phenyl-propyl)-amine::N-methyl-3-phenyl-1-propanamine;hydrochloride::N-methyl-3-phenyl-propan-1-amine;hydrochloride::N-methyl-3-phenylpropan-1-amine;hydrochloride::SMR000122043::cid_9549628::methyl(3-phenylpropyl)amine;hydrochloride

SMILES CNCCCc1ccccc1

InChI Key InChIKey=MLHBZVFOTDJTPK-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 32703   

TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 32703BDBM32703(cid_9549628 | SMR000122043 | N-methyl-3-phenyl-1-p...)
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
TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 32703BDBM32703(cid_9549628 | SMR000122043 | N-methyl-3-phenyl-1-p...)
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