General Information of the Compound
| Compound ID |
CP0127813
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| Compound Name |
(E)-3-(2,4-dimethoxyphenyl)-1-phenyl-2-propen-1-one
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| Structure |
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| Formula |
C17H16O3
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| Molecular Weight |
268.312
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| Canonical SMILES |
COc1ccc(\C=C\C(=O)c2ccccc2)c(OC)c1
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| InChI |
InChI=1S/C17H16O3/c1-19-15-10-8-14(17(12-15)20-2)9-11-16(18)13-6-4-3-5-7-13/h3-12H,1-2H3/b11-9+
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| InChIKey |
WIVAGKMXNMVMFC-PKNBQFBNSA-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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT01743, Polyunsaturated fatty acid 5-lipoxygenase