BDBM50621631 CHEMBL5438187

SMILES [O-]S(=O)(=O)Oc1ccc(C(=O)O[C@@H]2[C@@H](OC(=O)c3cc(OS([O-])(=O)=O)cc(OS([O-])(=O)=O)c3)[C@@H](OC(=O)c3cc(OS([O-])(=O)=O)cc(OS([O-])(=O)=O)c3)[C@H](OC(=O)c3cc(OS([O-])(=O)=O)cc(OS([O-])(=O)=O)c3)[C@H](OC(=O)c3cc(OS([O-])(=O)=O)cc(OS([O-])(=O)=O)c3)[C@H]2OC(=O)c2cc(OS([O-])(=O)=O)cc(OS([O-])(=O)=O)c2)c(OS([O-])(=O)=O)c1

InChI Key InChIKey=LAEWWFINXVBDMQ-UHFFFAOYSA-B

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50621631   

TargetCoagulation factor XI(Human)
Virginia Commonwealth University

Curated by ChEMBL
LigandPNGBDBM50621631(CHEMBL5438187)
Affinity DataIC50: 280nMAssay Description:Inhibition of human recombinant FXIa assessed as S-2366 hydrolysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2024
Entry Details
PubMed