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BDBM50292193 2-(6-Amino-3-chloro-1-oxy-pyridin-2-yl)-N-(2-aminomethyl-5-chloro-benzyl)-acetamide::CHEMBL194060

SMILES: NCc1ccc(Cl)cc1CNC(=O)Cc1c(Cl)ccc(N)[n+]1[O-]

InChI Key: InChIKey=YCYDZLMSTDWRGZ-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50292193   
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))
BDBM50292193
PNG
(2-(6-Amino-3-chloro-1-oxy-pyridin-2-yl)-N-(2-amino...)
Show SMILES NCc1ccc(Cl)cc1CNC(=O)Cc1c(Cl)ccc(N)[n+]1[O-]
Show InChI InChI=1S/C15H16Cl2N4O2/c16-11-2-1-9(7-18)10(5-11)8-20-15(22)6-13-12(17)3-4-14(19)21(13)23/h1-5H,6-8,18-19H2,(H,20,22)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
26n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against thrombin in human plasma


Bioorg Med Chem Lett 15: 2771-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.110
BindingDB Entry DOI: 10.7270/Q2PN96C6
More data for this
Ligand-Target Pair