BDBM41282 6-Amino-2-ethyl-8-phenethyl-2,3,8,8a-tetrahydro-1H-isoquinoline-5,7,7-tricarbonitrile::6-amino-2-ethyl-8-(2-phenylethyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile::6-amino-2-ethyl-8-phenethyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile::6-azanyl-2-ethyl-8-(2-phenylethyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile::MLS000075478::SMR000014048::cid_646956

SMILES CCN1CCC2=C(C#N)C(=N)C(C#N)(C#N)C(CCc3ccccc3)C2C1

InChI Key InChIKey=AHAICFGBSDVPNL-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 41282   

TargetCathepsin S(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM41282(6-Amino-2-ethyl-8-phenethyl-2,3,8,8a-tetrahydro-1H...)
Affinity DataIC50:  6.55E+3nMAssay Description:Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay