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SMILES: CCC1(C)CC(CCN)(CCO1)c1ccc(OC)cc1

InChI Key: InChIKey=JSZSRSVBYOBTJA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 25815   
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
Lanosterol 14-alpha demethylase


(Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)		BDBM25815
PNG
(2-[2-ethyl-4-(4-methoxyphenyl)-2-methyloxan-4-yl]e...)
Show SMILES CCC1(C)CC(CCN)(CCO1)c1ccc(OC)cc1
Show InChI InChI=1S/C17H27NO2/c1-4-16(2)13-17(9-11-18,10-12-20-16)14-5-7-15(19-3)8-6-14/h5-8H,4,9-13,18H2,1-3H3
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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 7.50E+3n/an/an/a7.537



University of California at San Francisco



Assay Description
The assay was developed based on the optical spectral property of P450 enzyme to elicit both type I and type II spectral changes (350 nm through 450 ...

Antimicrob Agents Chemother 51: 3915-23 (2007)


Article DOI: 10.1128/AAC.00311-07
BindingDB Entry DOI: 10.7270/Q20V8B3R
More data for this
Ligand-Target Pair