BDBM50210428 (2S,3aR,5S,6S,7aS)-1-{(S)-3-chloro-2-[(S)-3-hydroxy-2-((R)-methoxy)-propionylamino]-4-methyl-pentanoyl}-5,6-dihydroxy-octahydro-indole-2-carboxylic acid [2-(1-carbamimidoyl-2,5-dihydro-1H-pyrrol-3-yl)-ethyl]-amide::CHEMBL394402

SMILES CO[C@H](CO)C(=O)N[C@H]([C@@H](Cl)C(C)C)C(=O)N1[C@H]2C[C@H](O)[C@@H](O)C[C@H]2C[C@H]1C(=O)NCCC1=CCN(C1)C(N)=N

InChI Key InChIKey=HVKKNPBITJCJGO-UHFFFAOYSA-N

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 = 50210428   

TargetProthrombin(Human)
Université

Curated by ChEMBL
LigandPNGBDBM50210428((2S,3aR,5S,6S,7aS)-1-{(S)-3-chloro-2-[(S)-3-hydrox...)
Affinity DataIC50: 11nMAssay Description:Inhibition of thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed