BDBM32743 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [2-(methylamino)-2-oxoethyl] ester::4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [2-keto-2-(methylamino)ethyl] ester::MLS000565788::SMR000152883::[2-(methylamino)-2-oxidanylidene-ethyl] 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate::[2-(methylamino)-2-oxoethyl] 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate::cid_2120212

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

InChI Key InChIKey=RYBHVWCNMHCFMJ-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 32743   

TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32743(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid...)
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 DepthDetails PCBioAssay
TargetCoagulation factor XI(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32743(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid...)
Affinity DataIC50: >5.00E+4nMpH: 7.4 T: 23°CAssay Description:Factor XIa (0.23 ug/mL) was incubated with Boc-Glu-Ala-Arg-AMC substrate (15 uM) in 10 uL of assay buffer for 2 hr at room temperature. Read fluoresc...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay