General Information of the Compound
| Compound ID |
CP0211447
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| Compound Name |
(E)-3-[2,4-dimethoxy-6-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-N-(3,4,5-trimethoxyphenyl)prop-2-enamide
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| Structure |
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| Formula |
C29H31NO7
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| Molecular Weight |
505.567
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| Canonical SMILES |
COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1
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| InChI |
InChI=1S/C29H31NO7/c1-32-22-11-8-19(9-12-22)7-10-20-15-23(33-2)18-25(34-3)24(20)13-14-28(31)30-21-16-26(35-4)29(37-6)27(17-21)36-5/h7-18H,1-6H3,(H,30,31)/b10-7+,14-13+
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| InChIKey |
NKZWEPFMZIHOQD-CDITWBNYSA-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