General Information of the Compound
| Compound ID |
CP0499457
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| Compound Name |
2-(4-((5-(4-(Trifluoromethyl)phenyl)-4-(4-methoxyphenyl)thiazol-2-yl)methoxy)phenyl)acetic Acid
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| Structure |
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| Formula |
C26H20F3NO4S
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| Molecular Weight |
499.51
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| Canonical SMILES |
COc1ccc(cc1)-c1nc(COc2ccc(CC(O)=O)cc2)sc1-c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C26H20F3NO4S/c1-33-20-12-6-17(7-13-20)24-25(18-4-8-19(9-5-18)26(27,28)29)35-22(30-24)15-34-21-10-2-16(3-11-21)14-23(31)32/h2-13H,14-15H2,1H3,(H,31,32)
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| InChIKey |
RVXJUPZVCFYIAG-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