General Information of the Compound
| Compound ID |
CP0393525
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| Compound Name |
(S)-2-(4-Acetyl-phenoxy)-3-phenyl-propionic acid
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| Structure |
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| Formula |
C17H16O4
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| Molecular Weight |
284.311
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| Canonical SMILES |
CC(=O)c1ccc(O[C@@H](Cc2ccccc2)C(O)=O)cc1
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| InChI |
InChI=1S/C17H16O4/c1-12(18)14-7-9-15(10-8-14)21-16(17(19)20)11-13-5-3-2-4-6-13/h2-10,16H,11H2,1H3,(H,19,20)/t16-/m0/s1
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| InChIKey |
WDFFIFRBPUFLPS-INIZCTEOSA-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