General Information of the Compound
| Compound ID |
CP0568596
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| Compound Name |
US8802711, L
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| Structure |
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| Formula |
C20H19F3N4O2
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| Molecular Weight |
404.392
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| Canonical SMILES |
Cc1cccnc1N1CCC(=CC1)C(=O)Nc1ccc(cc1)C(=O)NC(F)(F)F
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| InChI |
InChI=1S/C20H19F3N4O2/c1-13-3-2-10-24-17(13)27-11-8-15(9-12-27)18(28)25-16-6-4-14(5-7-16)19(29)26-20(21,22)23/h2-8,10H,9,11-12H2,1H3,(H,25,28)(H,26,29)
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| InChIKey |
XCNPWFTZVTVCCJ-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