General Information of the Compound
| Compound ID |
CP0374026
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| Compound Name |
2-(4-((4-(Pyridin-3-yl)-5-(4-(trifluoromethoxy)phenyl)thiazol-2-yl)methoxy)-2-methylphenoxy)acetic Acid
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| Structure |
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| Formula |
C25H19F3N2O5S
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| Molecular Weight |
516.497
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| Canonical SMILES |
Cc1cc(OCc2nc(c(s2)-c2ccc(OC(F)(F)F)cc2)-c2cccnc2)ccc1OCC(O)=O
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| InChI |
InChI=1S/C25H19F3N2O5S/c1-15-11-19(8-9-20(15)34-14-22(31)32)33-13-21-30-23(17-3-2-10-29-12-17)24(36-21)16-4-6-18(7-5-16)35-25(26,27)28/h2-12H,13-14H2,1H3,(H,31,32)
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| InChIKey |
KFGHXHZEVDKCCE-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