General Information of the Compound
| Compound ID |
CP0230128
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| Compound Name |
2-[[5-[[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-2-fluorophenyl]methyl-(2-methylpropoxycarbonyl)amino]acetic acid
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| Structure |
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| Formula |
C25H26ClFN2O6
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| Molecular Weight |
504.942
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| Canonical SMILES |
CC(C)COC(=O)N(CC(O)=O)Cc1cc(OCc2nc(oc2C)-c2ccc(Cl)cc2)ccc1F
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| InChI |
InChI=1S/C25H26ClFN2O6/c1-15(2)13-34-25(32)29(12-23(30)31)11-18-10-20(8-9-21(18)27)33-14-22-16(3)35-24(28-22)17-4-6-19(26)7-5-17/h4-10,15H,11-14H2,1-3H3,(H,30,31)
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| InChIKey |
XCSGPDSJZUDEOX-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