General Information of the Compound
| Compound ID |
CP0569335
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| Compound Name |
2-[2-fluoro-4-[[3-methoxy-5-[(E)-2-(4-methoxyphenyl)ethenyl]phenoxy]methyl]phenoxy]acetic acid
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| Structure |
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| Formula |
C25H23FO6
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| Molecular Weight |
438.451
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| Canonical SMILES |
COc1ccc(\C=C\c2cc(OC)cc(OCc3ccc(OCC(O)=O)c(F)c3)c2)cc1
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| InChI |
InChI=1S/C25H23FO6/c1-29-20-8-5-17(6-9-20)3-4-18-11-21(30-2)14-22(12-18)31-15-19-7-10-24(23(26)13-19)32-16-25(27)28/h3-14H,15-16H2,1-2H3,(H,27,28)/b4-3+
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| InChIKey |
QASIQJGISCBDLW-ONEGZZNKSA-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