BDBM96236 12-Imino-9-propyl-10,11-dioxa-tricyclo[5.3.2.0*1,6*]dodecane-7,8,8-tricarbonitrile::MLS000556894::SMR000148011::cid_3725374

SMILES CCCC1OC23CCCCC2C(C#N)(C(=N)O3)C1(C#N)C#N

InChI Key InChIKey=QSYAOBUMIKSMLP-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 = 96236   

TargetFructose-bisphosphate aldolase(Mycobacterium tuberculosis (strain H37Rv))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM96236(12-Imino-9-propyl-10,11-dioxa-tricyclo[5.3.2.0*1,6...)
Affinity DataIC50: >9.99E+3nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay