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BDBM13892 2,2,2-trifluoroacetate; 4-[({1-[(3-carbamimidoylphenyl)methyl]-6-methoxy-1H-indol-2-yl}formamido)methyl]-N,N,N-trimethylanilinium::3-amidinobenzylindole carboxamide 77

SMILES: COc1ccc2cc(C(=O)NCc3ccc(cc3)[N+](C)(C)C)n(Cc3cccc(c3)C(N)=N)c2c1

InChI Key: InChIKey=PACCSSQPBHOMFO-UHFFFAOYSA-O

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 13892   
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
Coagulation factor X


(Homo sapiens (Human))
BDBM13892
PNG
(2,2,2-trifluoroacetate; 4-[({1-[(3-carbamimidoylph...)
Show SMILES COc1ccc2cc(C(=O)NCc3ccc(cc3)[N+](C)(C)C)n(Cc3cccc(c3)C(N)=N)c2c1
Show InChI InChI=1S/C28H31N5O2/c1-33(2,3)23-11-8-19(9-12-23)17-31-28(34)26-15-21-10-13-24(35-4)16-25(21)32(26)18-20-6-5-7-22(14-20)27(29)30/h5-16H,17-18H2,1-4H3,(H3-,29,30,31,34)/p+1
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Similars

Article
PubMed
1.76E+3n/an/an/an/an/an/an/an/a



Aventis Pharma Deutschland GmbH



Assay Description
The inhibitory effect of test compound for human fXa was determined by using the chromogenic substrates S-2765. The hydrolysis rates of chromogenic s...


J Med Chem 45: 2749-69 (2002)


Article DOI: 10.1021/jm0111346
BindingDB Entry DOI: 10.7270/Q27H1GTW
More data for this
Ligand-Target Pair