General Information of the Compound
| Compound ID |
CP0550387
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| Compound Name |
3-[3,5-difluoro-4-[[3-(4-methylphenyl)-5-(trifluoromethyl)-1,2-oxazol-4-yl]methoxy]phenyl]propanoic acid
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| Structure |
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| Formula |
C21H16F5NO4
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| Molecular Weight |
441.352
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| Canonical SMILES |
Cc1ccc(cc1)-c1noc(c1COc1c(F)cc(CCC(O)=O)cc1F)C(F)(F)F
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| InChI |
InChI=1S/C21H16F5NO4/c1-11-2-5-13(6-3-11)18-14(20(31-27-18)21(24,25)26)10-30-19-15(22)8-12(9-16(19)23)4-7-17(28)29/h2-3,5-6,8-9H,4,7,10H2,1H3,(H,28,29)
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| InChIKey |
ZXGYJOAZMNWOJL-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