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SMILES: Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc(s1)C(N)=NO[Si](C)(C)C(C)(C)C

InChI Key: InChIKey=SPILXEDPGQGHQN-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50111743   
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))		BDBM50111743
PNG
(2-(6-Methyl-2-oxo-3-phenethylamino-2H-pyrazin-1-yl...)
Show SMILES Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc(s1)C(N)=NO[Si](C)(C)C(C)(C)C |w:29.32|
Show InChI InChI=1S/C27H38N6O3SSi/c1-19-16-31-25(29-15-14-20-10-8-7-9-11-20)26(35)33(19)18-23(34)30-17-21-12-13-22(37-21)24(28)32-36-38(5,6)27(2,3)4/h7-13,16H,14-15,17-18H2,1-6H3,(H2,28,32)(H,29,31)(H,30,34)
PDB

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PC sid
UniChem

Similars
PubMed
 13n/an/an/an/an/an/an/an/a



Corvas International, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory constant against human thrombin (FIIa).

Bioorg Med Chem Lett 12: 1203-8 (2002)


BindingDB Entry DOI: 10.7270/Q2PK0FGB
More data for this
Ligand-Target Pair