General Information of the Compound
| Compound ID |
CP0479228
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| Compound Name |
US8614253, 43-50
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| Structure |
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| Formula |
C17H16O5
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| Molecular Weight |
300.31
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| Canonical SMILES |
CCOC(=O)c1ccccc1-c1cc(OC)c(O)c(C=O)c1
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| InChI |
InChI=1S/C17H16O5/c1-3-22-17(20)14-7-5-4-6-13(14)11-8-12(10-18)16(19)15(9-11)21-2/h4-10,19H,3H2,1-2H3
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| InChIKey |
NFPMECRFMDYGIR-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