General Information of the Compound
| Compound ID |
CP0428664
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| Compound Name |
7-[(2-methylbut-3-en-2-yl)amino]-4-(trifluoromethyl)-1,2-dihydroquinolin-2-one
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| Structure |
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| Formula |
C15H15F3N2O
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| Molecular Weight |
296.292
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| Canonical SMILES |
CC(C)(Nc1ccc2c(cc(=O)[nH]c2c1)C(F)(F)F)C=C
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| InChI |
InChI=1S/C15H15F3N2O/c1-4-14(2,3)20-9-5-6-10-11(15(16,17)18)8-13(21)19-12(10)7-9/h4-8,20H,1H2,2-3H3,(H,19,21)
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| InChIKey |
JGCAPFPVSHXPRA-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