General Information of the Compound
| Compound ID |
CP0406522
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| Compound Name |
(3E)-3-(ethoxyimino)-2-[(4-{[5-methyl-2-(propan-2-yl)-1,3-oxazol-4-yl]methoxy}phenyl)methyl]butanoic acid
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| Structure |
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| Formula |
C21H28N2O5
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| Molecular Weight |
388.464
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| Canonical SMILES |
CCO\N=C(/C)C(Cc1ccc(OCc2nc(oc2C)C(C)C)cc1)C(O)=O
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| InChI |
InChI=1S/C21H28N2O5/c1-6-27-23-14(4)18(21(24)25)11-16-7-9-17(10-8-16)26-12-19-15(5)28-20(22-19)13(2)3/h7-10,13,18H,6,11-12H2,1-5H3,(H,24,25)/b23-14+
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| InChIKey |
MFKFQVDTDFBZAZ-OEAKJJBVSA-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