General Information of the Compound
| Compound ID |
CP0427974
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| Compound Name |
1-[4-(3-ethyl-4-hydroxyphenyl)phenyl]ethanone
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| Structure |
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| Formula |
C16H16O2
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| Molecular Weight |
240.302
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| Canonical SMILES |
CCc1cc(ccc1O)-c1ccc(cc1)C(C)=O
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| InChI |
InChI=1S/C16H16O2/c1-3-12-10-15(8-9-16(12)18)14-6-4-13(5-7-14)11(2)17/h4-10,18H,3H2,1-2H3
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| InChIKey |
XXOYBRWXDUFYCE-UHFFFAOYSA-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