General Information of the Compound
| Compound ID |
CP0537461
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| Compound Name |
(E)-1-(5-bromo-2-hydroxyphenyl)-3-(2-ethoxyphenyl)prop-2-en-1-one
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| Structure |
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| Formula |
C17H15BrO3
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| Molecular Weight |
347.208
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| Canonical SMILES |
CCOc1ccccc1\C=C\C(=O)c1cc(Br)ccc1O
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| InChI |
InChI=1S/C17H15BrO3/c1-2-21-17-6-4-3-5-12(17)7-9-15(19)14-11-13(18)8-10-16(14)20/h3-11,20H,2H2,1H3/b9-7+
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| InChIKey |
WGVYETZCGPZSEX-VQHVLOKHSA-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