General Information of the Compound
| Compound ID |
CP0485772
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| Compound Name |
1-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)propane-1,3-dione
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| Structure |
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| Formula |
C19H20O4
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| Molecular Weight |
312.365
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| Canonical SMILES |
COc1ccccc1C(=O)CC(=O)c1ccc(OC(C)C)cc1
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| InChI |
InChI=1S/C19H20O4/c1-13(2)23-15-10-8-14(9-11-15)17(20)12-18(21)16-6-4-5-7-19(16)22-3/h4-11,13H,12H2,1-3H3
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| InChIKey |
YDTPYKVOMFUWBZ-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