General Information of the Compound
| Compound ID |
CP0386786
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| Compound Name |
2-methyl-2-[4-[2-(4-phenoxyphenoxy)ethyl]phenoxy]propanoic acid
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| Structure |
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| Formula |
C24H24O5
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| Molecular Weight |
392.451
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| Canonical SMILES |
CC(C)(Oc1ccc(CCOc2ccc(Oc3ccccc3)cc2)cc1)C(O)=O
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| InChI |
InChI=1S/C24H24O5/c1-24(2,23(25)26)29-22-10-8-18(9-11-22)16-17-27-19-12-14-21(15-13-19)28-20-6-4-3-5-7-20/h3-15H,16-17H2,1-2H3,(H,25,26)
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| InChIKey |
SZSMUACRRUJGKP-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