General Information of the Compound
| Compound ID |
CP0371989
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| Compound Name |
(2(S)-2-Ethoxy-3-(3-(5-phenyl-4,5-dihydroisoxazole-3-yl)phenyl)propanoic Acid
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| Structure |
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| Formula |
C20H21NO4
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| Molecular Weight |
339.391
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| Canonical SMILES |
CCO[C@@H](Cc1cccc(c1)C1=NOC(C1)c1ccccc1)C(O)=O
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| InChI |
InChI=1S/C20H21NO4/c1-2-24-19(20(22)23)12-14-7-6-10-16(11-14)17-13-18(25-21-17)15-8-4-3-5-9-15/h3-11,18-19H,2,12-13H2,1H3,(H,22,23)/t18?,19-/m0/s1
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| InChIKey |
DDXOKUHUAQEPLL-GGYWPGCISA-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