General Information of the Compound
| Compound ID |
CP0514759
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| Compound Name |
3-[[4-ethoxy-6-(2-methoxypyridin-4-yl)oxy-1-methylbenzimidazol-2-yl]methoxy]benzoic acid
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| Formula |
C24H23N3O6
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| Molecular Weight |
449.463
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| Canonical SMILES |
CCOc1cc(Oc2ccnc(OC)c2)cc2n(C)c(COc3cccc(c3)C(O)=O)nc12
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| InChI |
InChI=1S/C24H23N3O6/c1-4-31-20-12-18(33-17-8-9-25-22(13-17)30-3)11-19-23(20)26-21(27(19)2)14-32-16-7-5-6-15(10-16)24(28)29/h5-13H,4,14H2,1-3H3,(H,28,29)
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| InChIKey |
HKQNTFVDFCBUDF-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