General Information of the Compound
| Compound ID |
CP0392472
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| Compound Name |
N-[4-[4-(dimethylamino)piperidin-1-yl]sulfonylphenyl]-4-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C21H24F3N3O3S
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| Molecular Weight |
455.502
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| Canonical SMILES |
CN(C)C1CCN(CC1)S(=O)(=O)c1ccc(NC(=O)c2ccc(cc2)C(F)(F)F)cc1
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| InChI |
InChI=1S/C21H24F3N3O3S/c1-26(2)18-11-13-27(14-12-18)31(29,30)19-9-7-17(8-10-19)25-20(28)15-3-5-16(6-4-15)21(22,23)24/h3-10,18H,11-14H2,1-2H3,(H,25,28)
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| InChIKey |
SZBRLUOEGXOUIA-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