General Information of the Compound
| Compound ID |
CP0552563
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| Compound Name |
(E)-3-(3-hydroxy-4-methoxyphenyl)-N-[3-[[(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyl]amino]propyl]prop-2-enamide
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| Structure |
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| Formula |
C23H26N2O6
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| Molecular Weight |
426.469
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| Canonical SMILES |
COc1ccc(\C=C\C(=O)NCCCNC(=O)\C=C\c2ccc(OC)c(O)c2)cc1O
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| InChI |
InChI=1S/C23H26N2O6/c1-30-20-8-4-16(14-18(20)26)6-10-22(28)24-12-3-13-25-23(29)11-7-17-5-9-21(31-2)19(27)15-17/h4-11,14-15,26-27H,3,12-13H2,1-2H3,(H,24,28)(H,25,29)/b10-6+,11-7+
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| InChIKey |
FRQUBKFPIPDLSW-JMQWPVDRSA-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