BDBM50126517 2-[1-(4-Bromo-phenylsulfanylmethyl)-2-oxo-2-pyrrolidin-1-yl-ethyl]-1,3-dioxo-2,3,5,8-tetrahydro-1H-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxylic acid (6-amino-2-methyl-pyridin-3-ylmethyl)-amide::CHEMBL33247

SMILES Cc1nc(N)ccc1CNC(=O)C1C=CCn2n1c(=O)n(C(CSc1ccc(Br)cc1)C(=O)N1CCCC1)c2=O

InChI Key InChIKey=GXFZKQKWBJSMDX-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50126517   

TargetProthrombin(Human)
Molecumetics

Curated by ChEMBL
LigandPNGBDBM50126517(2-[1-(4-Bromo-phenylsulfanylmethyl)-2-oxo-2-pyrrol...)
Affinity DataKi:  30nMAssay Description:Inhibitory activity of the compound against human thrombinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed