General Information of the Compound
| Compound ID |
CP0301682
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| Compound Name |
(E)-3-[2,4-dimethoxy-6-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-N-(3-morpholin-4-ylpropyl)prop-2-enamide
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| Structure |
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| Formula |
C27H34N2O5
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| Molecular Weight |
466.578
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| Canonical SMILES |
COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)NCCCN2CCOCC2)cc1
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| InChI |
InChI=1S/C27H34N2O5/c1-31-23-9-6-21(7-10-23)5-8-22-19-24(32-2)20-26(33-3)25(22)11-12-27(30)28-13-4-14-29-15-17-34-18-16-29/h5-12,19-20H,4,13-18H2,1-3H3,(H,28,30)/b8-5+,12-11+
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| InChIKey |
OGXCWQYJRFVEAM-CQYWEGEGSA-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