General Information of the Compound
| Compound ID |
CP0417187
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| Compound Name |
(R)-3-phenyl-4-(2,2,2-trifluoroethyl)-10-(trifluoromethyl)-3,4-dihydro-2H-[1,4]oxazino[2,3-f]quinolin-8(7H)-one
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| Structure |
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| Formula |
C20H14F6N2O2
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| Molecular Weight |
428.332
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| Canonical SMILES |
FC(F)(F)CN1[C@@H](COc2c1ccc1[nH]c(=O)cc(c21)C(F)(F)F)c1ccccc1
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| InChI |
InChI=1S/C20H14F6N2O2/c21-19(22,23)10-28-14-7-6-13-17(12(20(24,25)26)8-16(29)27-13)18(14)30-9-15(28)11-4-2-1-3-5-11/h1-8,15H,9-10H2,(H,27,29)/t15-/m0/s1
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| InChIKey |
SEMQOOQLCBQNIV-HNNXBMFYSA-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