General Information of the Compound
| Compound ID |
CP0442166
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| Compound Name |
7-[ethyl(2,2,2-trifluoroethyl)amino]-4-(trifluoromethyl)-1,2-dihydroquinolin-2-one
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| Structure |
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| Formula |
C14H12F6N2O
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| Molecular Weight |
338.251
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| Canonical SMILES |
CCN(CC(F)(F)F)c1ccc2c(cc(=O)[nH]c2c1)C(F)(F)F
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| InChI |
InChI=1S/C14H12F6N2O/c1-2-22(7-13(15,16)17)8-3-4-9-10(14(18,19)20)6-12(23)21-11(9)5-8/h3-6H,2,7H2,1H3,(H,21,23)
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| InChIKey |
IFKQXZGNHOOIJT-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