General Information of the Compound
| Compound ID |
CP0381222
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| Compound Name |
2-Ethoxy-3-(4-(5-(4-(trifluoromethyl)phenyl)-4-(4-methoxyphenyl)thiazol-2-yl)methoxyphenyl)propanoic Acid
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| Structure |
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| Formula |
C29H26F3NO5S
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| Molecular Weight |
557.59
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| Canonical SMILES |
CCOC(Cc1ccc(OCc2nc(c(s2)-c2ccc(cc2)C(F)(F)F)-c2ccc(OC)cc2)cc1)C(O)=O
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| InChI |
InChI=1S/C29H26F3NO5S/c1-3-37-24(28(34)35)16-18-4-12-23(13-5-18)38-17-25-33-26(19-8-14-22(36-2)15-9-19)27(39-25)20-6-10-21(11-7-20)29(30,31)32/h4-15,24H,3,16-17H2,1-2H3,(H,34,35)
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| InChIKey |
WHYOEMGDHWLQND-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