BDBM50911 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[2-keto-2-(propylamino)ethyl] ester::3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[2-oxo-2-(propylamino)ethyl] ester::4-O-ethyl 2-O-[2-oxo-2-(propylamino)ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate::MLS000564272::O4-ethyl O2-[2-oxidanylidene-2-(propylamino)ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate::SMR000151822::cid_2442614

SMILES CCCNC(=O)COC(=O)c1[nH]c(C)c(C(=O)OCC)c1C

InChI Key InChIKey=IWDBEMBWCPVDOW-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50911   

TargetGlycoprotein 42(HHV-4)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM50911(3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-e...)
Affinity DataIC50: 5.40E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay