BDBM38314 2-[3-(1-azepanyl)-2-quinoxalinyl]-2-cyano-N-(2-methoxyethyl)acetamide::2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(2-methoxyethyl)acetamide::2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(2-methoxyethyl)ethanamide::MLS000079910::SMR000040506::cid_659475

SMILES COCCNC(=O)C(C#N)c1nc2ccccc2nc1N1CCCCCC1

InChI Key InChIKey=WYMWYIQTKUGUQH-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 = 38314   

TargetDiphosphomevalonate decarboxylase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38314(SMR000040506 | 2-[3-(1-azepanyl)-2-quinoxalinyl]-2...)
Affinity DataIC50: 1.90E+5nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2011
Entry Details
PCBioAssay