BDBM45918 (3aS,7aR)-2-(5-p-anisyl-1H-1,2,4-triazol-3-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone::(3aS,7aR)-2-[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione::MLS-0111913.0001::cid_16654900

SMILES COc1ccc(Cc2nnc([nH]2)-n2c(O)c3CC=CCc3c2O)cc1

InChI Key InChIKey=PILOMRQJHOAXRK-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 = 45918   

TargetAlkaline phosphatase, tissue-nonspecific isozyme(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM45918(MLS-0111913.0001 | cid_16654900 | (3aS,7aR)-2-[5-[...)
Affinity DataIC50: 9.60E+4nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay