General Information of the Compound
| Compound ID |
CP0252058
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| Compound Name |
US8614253, 43-53
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| Structure |
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| Formula |
C15H12O5
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| Molecular Weight |
272.256
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| Canonical SMILES |
COc1cc(cc(C=O)c1O)-c1ccccc1C(O)=O
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| InChI |
InChI=1S/C15H12O5/c1-20-13-7-9(6-10(8-16)14(13)17)11-4-2-3-5-12(11)15(18)19/h2-8,17H,1H3,(H,18,19)
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| InChIKey |
HTUVNAQWLXNZAO-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