General Information of the Compound
| Compound ID |
CP0761598
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| Compound Name |
5-(4-(4-(4-phenoxy-2-propylphenoxy)butoxy)phenyl)thiazolidine-2,4-dione
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| Structure |
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| Formula |
C28H29NO5S
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| Molecular Weight |
491.609
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| Canonical SMILES |
CCCc1cc(Oc2ccccc2)ccc1OCCCCOc1ccc(C2SC(=O)NC2=O)cc1
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| InChI |
InChI=1S/C28H29NO5S/c1-2-8-21-19-24(34-23-9-4-3-5-10-23)15-16-25(21)33-18-7-6-17-32-22-13-11-20(12-14-22)26-27(30)29-28(31)35-26/h3-5,9-16,19,26H,2,6-8,17-18H2,1H3,(H,29,30,31)
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| InChIKey |
MZIXKXKPGPURRW-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