General Information of the Compound
| Compound ID |
CP0433721
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| Compound Name |
2-(4-((5-(4-Phenyl-3-(trifluoromethyl)phenyl)-4-(4-methoxyphenyl)thiazol-2-yl)methoxy)-2-methylphenoxy)acetic Acid
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| Structure |
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| Formula |
C33H26F3NO5S
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| Molecular Weight |
605.634
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| Canonical SMILES |
COc1ccc(cc1)-c1nc(COc2ccc(OCC(O)=O)c(C)c2)sc1-c1ccc(-c2ccccc2)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C33H26F3NO5S/c1-20-16-25(13-15-28(20)42-19-30(38)39)41-18-29-37-31(22-8-11-24(40-2)12-9-22)32(43-29)23-10-14-26(21-6-4-3-5-7-21)27(17-23)33(34,35)36/h3-17H,18-19H2,1-2H3,(H,38,39)
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| InChIKey |
MAAGVASBIGMIOW-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