BDBM45467 MLS000520890::N-[2-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]benzamide::N-[2-[2-(butan-2-ylamino)-2-oxoethyl]sulfanyl-4-oxothieno[3,2-d]pyrimidin-3-yl]benzamide::N-[2-[[2-(butan-2-ylamino)-2-oxoethyl]thio]-4-oxo-3-thieno[3,2-d]pyrimidinyl]benzamide::N-[4-keto-2-[[2-keto-2-(sec-butylamino)ethyl]thio]thieno[3,2-d]pyrimidin-3-yl]benzamide::SMR000131299::cid_4170428

SMILES CCC(C)NC(=O)CSc1nc2ccsc2c(=O)n1NC(=O)c1ccccc1

InChI Key InChIKey=PPYYOIXOWFPLCL-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 = 45467   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM45467(cid_4170428 | N-[2-[2-(butan-2-ylamino)-2-oxidanyl...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay