General Information of the Compound
| Compound ID |
CP0421055
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| Compound Name |
2,2,2-trifluoro-N-[1-[3-[4-(4-phenylmethoxyphenoxy)phenyl]-1,2,4-oxadiazol-5-yl]ethyl]acetamide
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| Structure |
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| Formula |
C25H20F3N3O4
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| Molecular Weight |
483.446
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| Canonical SMILES |
CC(NC(=O)C(F)(F)F)c1nc(no1)-c1ccc(Oc2ccc(OCc3ccccc3)cc2)cc1
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| InChI |
InChI=1S/C25H20F3N3O4/c1-16(29-24(32)25(26,27)28)23-30-22(31-35-23)18-7-9-20(10-8-18)34-21-13-11-19(12-14-21)33-15-17-5-3-2-4-6-17/h2-14,16H,15H2,1H3,(H,29,32)
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| InChIKey |
CHULCTKIKFMDOO-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: PT00909, Peroxisome proliferator-activated receptor delta