BDBM50195763 CHEMBL387841::N-{(1S)-1-{[4-(3-AMINOPROPYL)PIPERAZIN-1-YL]CARBONYL}-4-[(DIAMINOMETHYLENE)AMINO]BUTYL}-3-(TRIFLUOROMETHYL)BENZENESULFONAMIDE::N-{(S)-1-[4-(3-amino-propyl)-piperazine-1-carbonyl]-4-guanidino-butyl}-3-trifluoromethyl-benzenesulfonamide

SMILES NCCCN1CCN(C(=O)[C@H](CCCN=C(N)N)NS(=O)(=O)c2cccc(C(F)(F)F)c2)CC1

InChI Key InChIKey=KGJKWHCPJPBEJP-UHFFFAOYSA-N

Data  1 KI

PDB links: 1 PDB ID matches this monomer.

  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 = 50195763   

TargetProthrombin(Human)
Université

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50195763BDBM50195763(N-{(S)-1-[4-(3-amino-propyl)-piperazine-1-carbonyl...)
Affinity DataKi:  1.90E+3nMAssay Description:Inhibition of human alpha thrombinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)