General Information of the Compound
| Compound ID |
CP0373957
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| Compound Name |
2-(4-((4-(6-Benzo[d]oxazol-2(3H)-one)-5-(4-(trifluoromethoxy)-phenyl)thiazol-2-yl)methoxy)-2-methylphenoxy)acetic Acid
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| Structure |
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| Formula |
C27H19F3N2O7S
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| Molecular Weight |
572.517
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| Canonical SMILES |
Cc1cc(OCc2nc(c(s2)-c2ccc(OC(F)(F)F)cc2)-c2ccc3[nH]c(=O)oc3c2)ccc1OCC(O)=O
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| InChI |
InChI=1S/C27H19F3N2O7S/c1-14-10-18(7-9-20(14)37-13-23(33)34)36-12-22-32-24(16-4-8-19-21(11-16)38-26(35)31-19)25(40-22)15-2-5-17(6-3-15)39-27(28,29)30/h2-11H,12-13H2,1H3,(H,31,35)(H,33,34)
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| InChIKey |
ZNAIOXHNTVGEJB-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