General Information of the Compound
| Compound ID |
CP0550911
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| Compound Name |
methyl (2E)-2-[2-[[3-[(4-ethenylphenyl)methoxy]phenoxy]methyl]phenyl]-2-methoxyiminoacetate
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| Structure |
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| Formula |
C26H25NO5
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| Molecular Weight |
431.488
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| Canonical SMILES |
CO\N=C(\C(=O)OC)c1ccccc1COc1cccc(OCc2ccc(C=C)cc2)c1
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| InChI |
InChI=1S/C26H25NO5/c1-4-19-12-14-20(15-13-19)17-31-22-9-7-10-23(16-22)32-18-21-8-5-6-11-24(21)25(27-30-3)26(28)29-2/h4-16H,1,17-18H2,2-3H3/b27-25+
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| InChIKey |
BEYWOOOXKBUXJO-IMVLJIQESA-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