General Information of the Compound
| Compound ID |
CP0230174
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| Compound Name |
3-[[1-methyl-6-[3-(trifluoromethoxy)phenoxy]benzimidazol-2-yl]methoxy]benzoic acid
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| Structure |
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| Formula |
C23H17F3N2O5
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| Molecular Weight |
458.392
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| Canonical SMILES |
Cn1c(COc2cccc(c2)C(O)=O)nc2ccc(Oc3cccc(OC(F)(F)F)c3)cc12
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| InChI |
InChI=1S/C23H17F3N2O5/c1-28-20-12-17(32-16-6-3-7-18(11-16)33-23(24,25)26)8-9-19(20)27-21(28)13-31-15-5-2-4-14(10-15)22(29)30/h2-12H,13H2,1H3,(H,29,30)
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| InChIKey |
ZKTOXNZNHAZRCB-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00910, Peroxisome proliferator-activated receptor alpha
Protein ID: PT00915, Peroxisome proliferator-activated receptor gamma