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. 2015 Jul 17;6(8):861–865. doi: 10.1021/acsmedchemlett.5b00048

Table 1. Effect of Triazole Substitution on CYP11B2 and B1 Inhibition and LLE.

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Cpd R CYP11B2a (IC50, nM) CYP11B1a (IC50, nM) B1/B2b LLEc
1 H 300 >10000 >33 4.59
2 Me 423 >10000 >24 4.18
3 c-Pr 487 >10000 >21 3.36
4 CF3 506 >8333 >16 3.02
5 Cy 2400 >8333 >3 1.30
6 Ph 103 1357 13 3.13
a

IC50s calculated from n ≥ 2, see Supporting Information for details.

b

Ratio of hCYP11B1 IC50/hCYP11B2 IC50.

c

Ligand lipophilic efficiency; LLE = pIC50 – aLogP98.