General Information of the Compound
| Compound ID |
CP0384444
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| Compound Name |
5-((5-(4-(Trifluoromethyl)phenyl)-4-(4-methoxyphenyl)thiazol-2-yl)methoxy)-2,3-dihydrobenzofuran-2-carboxylic Acid
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| Structure |
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| Formula |
C27H20F3NO5S
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| Molecular Weight |
527.52
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| Canonical SMILES |
COc1ccc(cc1)-c1nc(COc2ccc3OC(Cc3c2)C(O)=O)sc1-c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C27H20F3NO5S/c1-34-19-8-4-15(5-9-19)24-25(16-2-6-18(7-3-16)27(28,29)30)37-23(31-24)14-35-20-10-11-21-17(12-20)13-22(36-21)26(32)33/h2-12,22H,13-14H2,1H3,(H,32,33)
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| InChIKey |
MFCORXDLLLGYGU-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