General Information of the Compound
| Compound ID |
CP0181463
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| Compound Name |
2-[[2-fluoro-5-[[5-methyl-2-[4-(trifluoromethoxy)phenyl]-1,3-oxazol-4-yl]methoxy]phenyl]methyl-methoxycarbonylamino]acetic acid
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| Structure |
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| Formula |
C23H20F4N2O7
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| Molecular Weight |
512.412
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| Canonical SMILES |
COC(=O)N(CC(O)=O)Cc1cc(OCc2nc(oc2C)-c2ccc(OC(F)(F)F)cc2)ccc1F
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| InChI |
InChI=1S/C23H20F4N2O7/c1-13-19(28-21(35-13)14-3-5-16(6-4-14)36-23(25,26)27)12-34-17-7-8-18(24)15(9-17)10-29(11-20(30)31)22(32)33-2/h3-9H,10-12H2,1-2H3,(H,30,31)
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| InChIKey |
XNQSRMZMKDJXQI-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