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SMILES: Cc1cc(NS(=O)(=O)c2ccccc2)cc(OCCCNC(N)=N)c1

InChI Key: InChIKey=KSDDZSJNEMTHNS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50070622   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Prothrombin


(Homo sapiens (Human))		BDBM50070622
PNG
(CHEMBL40704 | N-[3-(3-Guanidino-propoxy)-5-methyl-...)
Show SMILES Cc1cc(NS(=O)(=O)c2ccccc2)cc(OCCCNC(N)=N)c1
Show InChI InChI=1S/C17H22N4O3S/c1-13-10-14(21-25(22,23)16-6-3-2-4-7-16)12-15(11-13)24-9-5-8-20-17(18)19/h2-4,6-7,10-12,21H,5,8-9H2,1H3,(H4,18,19,20)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 630n/an/an/an/an/an/an/an/a



Pharmazeutisch-Chemisches Institut der Universität

Curated by ChEMBL


Assay Description
Inhibitory activity against thrombin

Bioorg Med Chem Lett 8: 1613-8 (1999)


BindingDB Entry DOI: 10.7270/Q2VH5N09
More data for this
Ligand-Target Pair