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SMILES: C[C@@H](NC(=O)c1ccc(N)cc1)c1cccc2ccccc12

InChI Key: InChIKey=FDZAZVZWUCGTFM-CYBMUJFWSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 31522   
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
Replicase polyprotein 1ab [1541-1855]


(Human SARS coronavirus (SARS-CoV))		BDBM31522
PNG
(Naphthalene and Benzamide Derivative, 23)
Show SMILES C[C@@H](NC(=O)c1ccc(N)cc1)c1cccc2ccccc12 |r|
Show InChI InChI=1S/C19H18N2O/c1-13(21-19(22)15-9-11-16(20)12-10-15)17-8-4-6-14-5-2-3-7-18(14)17/h2-13H,20H2,1H3,(H,21,22)/t13-/m1/s1
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PC cid
PC sid
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Similars
Article
PubMed
n/an/a 2.48E+4n/an/an/an/a7.523



Purdue University



Assay Description
IC50 values for all inhibitors were determined using a 96-well plate based assay. Reactions were performed in buffer containing RLRGG-AMC, 2% DMSO, a...

J Med Chem 52: 5228-40 (2009)


Article DOI: 10.1021/jm900611t
BindingDB Entry DOI: 10.7270/Q2P8497Z
More data for this
Ligand-Target Pair		3D
3D Structure (docked)