General Information of the Compound
| Compound ID |
CP0254951
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| Compound Name |
1-(2,4-dihydroxy-6-methoxyphenyl)-3-methylbutan-1-one
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| Structure |
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| Formula |
C12H16O4
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| Molecular Weight |
224.256
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| Canonical SMILES |
COc1cc(O)cc(O)c1C(=O)CC(C)C
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| InChI |
InChI=1S/C12H16O4/c1-7(2)4-9(14)12-10(15)5-8(13)6-11(12)16-3/h5-7,13,15H,4H2,1-3H3
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| InChIKey |
CSDLKVWYPVAIKE-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