BDBM50072531 (6S,8aS)-2-[(S)-2-Amino-3-(1H-indol-3-yl)-propionyl]-4-oxo-octahydro-pyrrolo[1,2-a]pyrazine-6-carboxylic acid [4-guanidino-1-(thiazole-2-carbonyl)-butyl]-amide::CHEMBL320781

SMILES N=C(N)NCCCC(NC(=O)[C@@H]1CC[C@H]2CN(C(=O)[C@@H](N)Cc3c[nH]c4ccccc34)CC(=O)N21)C(=O)c1nccs1

InChI Key InChIKey=CKOOAUGBMGMXTB-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50072531   

TargetProthrombin(Human)
Biochem Therapeutic

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50072531BDBM50072531((6S,8aS)-2-[(S)-2-Amino-3-(1H-indol-3-yl)-propiony...)
Affinity DataKi:  75nMAssay Description:Binding affinity against thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetProthrombin(Human)
Biochem Therapeutic

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50072531BDBM50072531((6S,8aS)-2-[(S)-2-Amino-3-(1H-indol-3-yl)-propiony...)
Affinity DataKi:  75.3nMAssay Description:Binding affinity against thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed