General Information of the Compound
| Compound ID |
CP0412843
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| Compound Name |
2-[4-[[4-[(2Z)-2-methoxyimino-2-phenylethoxy]phenyl]methoxy]phenyl]sulfonylacetic acid
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| Structure |
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| Formula |
C24H23NO7S
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| Molecular Weight |
469.515
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| Canonical SMILES |
CO\N=C(/COc1ccc(COc2ccc(cc2)S(=O)(=O)CC(O)=O)cc1)c1ccccc1
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| InChI |
InChI=1S/C24H23NO7S/c1-30-25-23(19-5-3-2-4-6-19)16-32-20-9-7-18(8-10-20)15-31-21-11-13-22(14-12-21)33(28,29)17-24(26)27/h2-14H,15-17H2,1H3,(H,26,27)/b25-23+
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| InChIKey |
IOWUPIZKNBUFMG-WJTDDFOZSA-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