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SMILES: CCCN(CC1CC1)C(=O)c1cc(Cl)cc(OCCCONC(N)=N)c1

InChI Key: InChIKey=SXNBAAUZQASUCP-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50149010   
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))		BDBM50149010
PNG
(CHEMBL339909 | Oxyguanidine derivative)
Show SMILES CCCN(CC1CC1)C(=O)c1cc(Cl)cc(OCCCONC(N)=N)c1
Show InChI InChI=1S/C18H27ClN4O3/c1-2-6-23(12-13-4-5-13)17(24)14-9-15(19)11-16(10-14)25-7-3-8-26-22-18(20)21/h9-11,13H,2-8,12H2,1H3,(H4,20,21,22)
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Similars
Article
PubMed
 23n/an/an/an/an/an/an/an/a



3-Dimensional Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against thrombin

Bioorg Med Chem Lett 14: 3727-31 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.002
BindingDB Entry DOI: 10.7270/Q2D79C0Q
More data for this
Ligand-Target Pair