BDBM197316 SAMPL5, CBC-G3

SMILES [NH3+]CCC[NH2+]CCCC[NH2+]CCC[NH3+]

InChI Key InChIKey=PFNFFQXMRSDOHW-UHFFFAOYSA-R

Data  1 Kd  1 ITC

PDB links: 11 PDB IDs match this monomer.

  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 = 197316   

Host:PNGBDBM197310(SAMPL5, CBClip)
University Of California San Diego

LigandPNGBDBM197316(SAMPL5, CBC-G3)
Affinity DataKd:  1.14E+6nMpH: 7.4 T: 2°CAssay Description:The experimental studies were carried out in 20 mM sodium phosphate buffer at pH7.4, at a temperature of 298 K.More data for this Ligand-Host Pair
In DepthDetails ArticlePubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 197316   

HostPNGBDBM197310(SAMPL5, CBClip)
University Of California San Diego

GuestPNGBDBM197316(SAMPL5, CBC-G3)
ITC DataΔG°: -4.01kcal/mole logk: 880
pH: 7.4 T: 24.85°C 
In DepthDetails ArticlePubMed