General Information of the Compound
| Compound ID |
CP0406362
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| Compound Name |
2-{4-[2-(5-Methyl-2-phenyl-oxazol-4-yl)-ethoxy]-benzyl}-2-phenoxy-butyric acid
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| Structure |
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| Formula |
C29H29NO5
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| Molecular Weight |
471.553
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| Canonical SMILES |
CCC(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)(Oc1ccccc1)C(O)=O
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| InChI |
InChI=1S/C29H29NO5/c1-3-29(28(31)32,35-25-12-8-5-9-13-25)20-22-14-16-24(17-15-22)33-19-18-26-21(2)34-27(30-26)23-10-6-4-7-11-23/h4-17H,3,18-20H2,1-2H3,(H,31,32)
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| InChIKey |
PWZALNZYZAMBJL-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: PT00915, Peroxisome proliferator-activated receptor gamma