General Information of the Compound
| Compound ID |
CP0485798
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| Compound Name |
2-(ethoxymethyl)-1-(2,2,2-trifluoroethyl)-9-(trifluoromethyl)-3,6-dihydro-2H-pyrido[3,2-g][1,4]benzoxazin-7-one
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| Structure |
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| Formula |
C17H16F6N2O3
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| Molecular Weight |
410.314
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| Canonical SMILES |
CCOCC1COc2cc3[nH]c(=O)cc(c3cc2N1CC(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C17H16F6N2O3/c1-2-27-6-9-7-28-14-5-12-10(3-13(14)25(9)8-16(18,19)20)11(17(21,22)23)4-15(26)24-12/h3-5,9H,2,6-8H2,1H3,(H,24,26)
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| InChIKey |
LGNNPMLVSVGWSH-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