BDBM50126531 2-{5-[(6-Amino-2-methyl-pyridin-3-ylmethyl)-carbamoyl]-1,3-dioxo-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazin-2-yl}-3-phenylsulfanyl-propionic acid methyl ester::CHEMBL289668

SMILES COC(=O)C(CSc1ccccc1)n1c(=O)n2CC=CC(C(=O)NCc3ccc(N)nc3C)n2c1=O

InChI Key InChIKey=PFZIJAVARPSGTC-UHFFFAOYSA-N

Data  1 KI

  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 = 50126531   

TargetProthrombin(Human)
Molecumetics

Curated by ChEMBL
LigandPNGBDBM50126531(2-{5-[(6-Amino-2-methyl-pyridin-3-ylmethyl)-carbam...)
Affinity DataKi:  32nMAssay Description:Inhibitory activity against human thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed