General Information of the Compound
| Compound ID |
CP0113396
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| Compound Name |
2-(3,4-dimethoxyphenyl)chromen-4-one
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| Structure |
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| Formula |
C17H14O4
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| Molecular Weight |
282.295
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| Canonical SMILES |
COc1ccc(cc1OC)-c1cc(=O)c2ccccc2o1
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| InChI |
InChI=1S/C17H14O4/c1-19-15-8-7-11(9-17(15)20-2)16-10-13(18)12-5-3-4-6-14(12)21-16/h3-10H,1-2H3
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| InChIKey |
ZGHORMOOTZTQFL-UHFFFAOYSA-N
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| CAS |
4143-62-8
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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