BDBM586500 CatS_16

SMILES [#6]-[#7](-[#6])-[#6]-[#6]-[#6]-n1nc(c2-[#6]-[#7](-[#6]-[#6]-c12)-[#6](=O)-[#6]-[#6]-1-[#6]-[#6]-[#7]-[#6]-[#6]-1)-c1ccc(c(-[#6]-[#7]-[#6](=O)\[#6]=[#6](\[#6])-[#6])c1)C(F)(F)F

InChI Key InChIKey=YYKUWQZWTBVESL-UHFFFAOYSA-N

Data  1 IC50

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 586500   

TargetCathepsin S(Human)
D3R/Abbott

LigandPNGBDBM586500(CatS_16)
Affinity DataIC50:  260nMAssay Description:D3R2020More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails D3R
PDB3D3D Structure (crystal)