General Information of the Compound
| Compound ID |
CP0458705
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| Compound Name |
6-methyl-1-(2-methylpropyl)-4-[[4-(trifluoromethyl)phenyl]methylamino]pyridin-2-one
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| Structure |
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| Formula |
C18H21F3N2O
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| Molecular Weight |
338.373
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| Canonical SMILES |
CC(C)Cn1c(C)cc(NCc2ccc(cc2)C(F)(F)F)cc1=O
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| InChI |
InChI=1S/C18H21F3N2O/c1-12(2)11-23-13(3)8-16(9-17(23)24)22-10-14-4-6-15(7-5-14)18(19,20)21/h4-9,12,22H,10-11H2,1-3H3
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| InChIKey |
DQGLCUVKAXPIQI-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