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BDBM50370218 TIOCONAZOLE

SMILES: Clc1sccc1COC(Cn1ccnc1)c1ccc(Cl)cc1Cl

InChI Key: InChIKey=QXHHHPZILQDDPS-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50370218   
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 17A1


(Homo sapiens (human))
BDBM50370218
PNG
(TIOCONAZOLE)
Show SMILES Clc1sccc1COC(Cn1ccnc1)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C16H13Cl3N2OS/c17-12-1-2-13(14(18)7-12)15(8-21-5-4-20-10-21)22-9-11-3-6-23-16(11)19/h1-7,10,15H,8-9H2
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505n/an/an/an/an/an/an/an/a



Accelrys

Curated by ChEMBL


Assay Description
In vitro inhibition of human Cytochrome P450 17A1 activity


J Med Chem 46: 2345-51 (2003)

More data for this
Ligand-Target Pair