General Information of the Compound
| Compound ID |
CP0292674
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| Compound Name |
US8614253, 43-49
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| Structure |
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| Formula |
C17H14F3NO3
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| Molecular Weight |
337.297
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| Canonical SMILES |
CN(C)C(=O)c1cccc(c1)-c1cc(C=O)c(O)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C17H14F3NO3/c1-21(2)16(24)11-5-3-4-10(6-11)12-7-13(9-22)15(23)14(8-12)17(18,19)20/h3-9,23H,1-2H3
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| InChIKey |
LLNWBRLXZZTRPD-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