General Information of the Compound
| Compound ID |
CP0520532
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| Compound Name |
US9216968, 6
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| Structure |
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| Formula |
C25H18F6N2O3
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| Molecular Weight |
508.418
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| Canonical SMILES |
FC(F)(F)c1ccccc1CNC(=O)c1cc(NC(=O)c2ccccc2C(F)(F)F)cc2CCOc12
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| InChI |
InChI=1S/C25H18F6N2O3/c26-24(27,28)19-7-3-1-5-15(19)13-32-22(34)18-12-16(11-14-9-10-36-21(14)18)33-23(35)17-6-2-4-8-20(17)25(29,30)31/h1-8,11-12H,9-10,13H2,(H,32,34)(H,33,35)
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| InChIKey |
QLXVDKZGAPSTNF-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