BDBM50212176 CHEMBL399776::N-((5R,14S)-5-amino-5,14-dimethyl-16-oxo-3-oxa-15-aza-tricyclo[15.3.1.1*7,11*]docosa-1(21),7,9,11(22),17,19-hexaen-19-yl)-N-propyl-methanesulfonamide

SMILES CCCN(c1cc2COC[C@](C)(N)Cc3cccc(CC[C@H](C)NC(=O)c(c2)c1)c3)S(C)(=O)=O

InChI Key InChIKey=VRIHLHHQRFZTNO-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 = 50212176   

TargetBeta-secretase 1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50212176(N-((5R,14S)-5-amino-5,14-dimethyl-16-oxo-3-oxa-15-...)
Affinity DataIC50: 290nMAssay Description:Inhibition of BACE1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed