General Information of the Compound
| Compound ID |
CP0722045
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| Compound Name |
(+/-)-2-((2-Oxo-2H-chromen-6-yl)oxy)ethyl 2-(3-Benzoylphenyl)propanoate
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| Structure |
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| Formula |
C27H22O6
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| Molecular Weight |
442.467
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| Canonical SMILES |
CC(C(=O)OCCOc1ccc2oc(=O)ccc2c1)c1cccc(C(=O)c2ccccc2)c1
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| InChI |
InChI=1S/C27H22O6/c1-18(20-8-5-9-22(16-20)26(29)19-6-3-2-4-7-19)27(30)32-15-14-31-23-11-12-24-21(17-23)10-13-25(28)33-24/h2-13,16-18H,14-15H2,1H3
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| InChIKey |
HJQBHXQMKDPYRB-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