General Information of the Compound
| Compound ID |
CP0237079
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| Compound Name |
N-[4-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]sulfonylphenyl]prop-2-enamide
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| Structure |
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| Formula |
C19H19F3N4O3S
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| Molecular Weight |
440.447
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| Canonical SMILES |
FC(F)(F)c1ccc(nc1)N1CCN(CC1)S(=O)(=O)c1ccc(NC(=O)C=C)cc1
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| InChI |
InChI=1S/C19H19F3N4O3S/c1-2-18(27)24-15-4-6-16(7-5-15)30(28,29)26-11-9-25(10-12-26)17-8-3-14(13-23-17)19(20,21)22/h2-8,13H,1,9-12H2,(H,24,27)
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| InChIKey |
GFUHZWGGEHHBLH-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