General Information of the Compound
| Compound ID |
CP0430321
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| Compound Name |
2-(4-((5-(Benzofuran-2-yl)-4-(4-methoxyphenyl)thiazol-2-yl)-methoxy)-2-methylphenoxy)acetic Acid
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| Structure |
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| Formula |
C28H23NO6S
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| Molecular Weight |
501.56
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| Canonical SMILES |
COc1ccc(cc1)-c1nc(COc2ccc(OCC(O)=O)c(C)c2)sc1-c1cc2ccccc2o1
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| InChI |
InChI=1S/C28H23NO6S/c1-17-13-21(11-12-22(17)34-16-26(30)31)33-15-25-29-27(18-7-9-20(32-2)10-8-18)28(36-25)24-14-19-5-3-4-6-23(19)35-24/h3-14H,15-16H2,1-2H3,(H,30,31)
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| InChIKey |
UIZUBPZOZKKCKN-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: PT00909, Peroxisome proliferator-activated receptor delta
Protein ID: PT00915, Peroxisome proliferator-activated receptor gamma