BDBM92269 CS259

SMILES C[C@@H](O)[C@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO

InChI Key InChIKey=SFYISUPIFOZKLQ-UHFFFAOYSA-N

Data  1 KI  3 Kd

PDB links: 1 PDB ID matches 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 4 hits for monomerid = 92269   

TargetUDP-3-O-acyl-N-acetylglucosamine deacetylase(Aquifex aeolicus (strain VF5))
Csar

LigandPNGBDBM92269(CS259)
Affinity DataKd:  1.21E+3nMpH: 7.0 T: 2°CAssay Description:ITCMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetUDP-3-O-acyl-N-acetylglucosamine deacetylase(Aquifex aeolicus (strain VF5))
Csar

LigandPNGBDBM92269(CS259)
Affinity DataKd:  20nMpH: 7.0 T: 2°CAssay Description:ThermofluorMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetUDP-3-O-acyl-N-acetylglucosamine deacetylase(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
D3R/Abbott

LigandPNGBDBM92269(CS259)
Affinity DataKd:  20.1nMAssay Description:Thermofluor_Method1More data for this Ligand-Target Pair
In DepthDetails
D3R
PDB3D3D Structure (crystal)
TargetUDP-3-O-acyl-N-acetylglucosamine deacetylase(Aquifex aeolicus (strain VF5))
Csar

LigandPNGBDBM92269(CS259)
Affinity DataKi:  1nM ΔG°:  -12.3kcal/molepH: 7.0 T: 2°CAssay Description:OctetRedMore data for this Ligand-Target Pair
In DepthDetails PubMed