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SMILES: C[C@H](NC(=O)c1c(C)c(nc2ccccc12)-c1cccs1)C1CCCCC1

InChI Key: InChIKey=WMBASSFERSEZSH-INIZCTEOSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50416314   
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
Cytochrome P450 2C9


(Homo sapiens (Human))		BDBM50416314
PNG
(CHEMBL1171894)
Show SMILES C[C@H](NC(=O)c1c(C)c(nc2ccccc12)-c1cccs1)C1CCCCC1 |r|
Show InChI InChI=1S/C23H26N2OS/c1-15-21(23(26)24-16(2)17-9-4-3-5-10-17)18-11-6-7-12-19(18)25-22(15)20-13-8-14-27-20/h6-8,11-14,16-17H,3-5,9-10H2,1-2H3,(H,24,26)/t16-/m0/s1
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MMDB

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Article
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Inhibition of CYP2C9

Bioorg Med Chem 17: 5906-19 (2009)


Article DOI: 10.1016/j.bmc.2009.07.002
BindingDB Entry DOI: 10.7270/Q2Z039DJ
More data for this
Ligand-Target Pair