BDBM19691 (1S)-2-cyclohexyl-1-[(2-methoxyethyl)(methyl)carbamoyl]ethyl N-[(2S)-1-(5-fluoro-3,3-dimethyl-2,3-dihydro-1H-indol-1-yl)propan-2-yl]carbamate::Arylaminoethyl carbamate, 25

SMILES COCCN(C)C(=O)[C@H](CC1CCCCC1)OC(=O)N[C@@H](C)CN1CC(C)(C)c2cc(F)ccc12

InChI Key InChIKey=BVUVFXYKXLUFDM-CYFREDJKSA-N

Data  1 KI

  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 1 hit for monomerid = 19691   

TargetCathepsin S(Homo sapiens (Human))
Gnf

LigandPNGBDBM19691((1S)-2-cyclohexyl-1-[(2-methoxyethyl)(methyl)carba...)
Affinity DataKi:  172nM ΔG°:  -9.59kcal/molepH: 5.5 T: 2°CAssay Description:The recombinant human cathepsin enzyme was preincubated with inhibitor for 20 minutes prior to addition of substrate. The substrate hydrolysis was mo...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed