General Information of the Compound
| Compound ID |
CP0411694
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| Compound Name |
(2S)-2-[4-[(E)-hydroxyiminomethyl]phenoxy]-3-phenylpropanoic acid
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| Structure |
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| Formula |
C16H15NO4
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| Molecular Weight |
285.299
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| Canonical SMILES |
O\N=C\c1ccc(O[C@@H](Cc2ccccc2)C(O)=O)cc1
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| InChI |
InChI=1S/C16H15NO4/c18-16(19)15(10-12-4-2-1-3-5-12)21-14-8-6-13(7-9-14)11-17-20/h1-9,11,15,20H,10H2,(H,18,19)/b17-11+/t15-/m0/s1
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| InChIKey |
NIDDHYAQKFHAMY-VUVCFOEZSA-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