General Information of the Compound
| Compound ID |
CP0959873
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| Compound Name |
N-[2-(Quinolin-8-ylsulfamoyl)-5-trifluoromethyl-phenyl]-isobutyramide
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| Structure |
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| Formula |
C20H18F3N3O3S
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| Molecular Weight |
437.443
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| Canonical SMILES |
CC(C)C(=O)Nc1cc(C(F)(F)F)ccc1S(=O)(=O)Nc1cccc2cccnc12
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| InChI |
InChI=1S/C20H18F3N3O3S/c1-12(2)19(27)25-16-11-14(20(21,22)23)8-9-17(16)30(28,29)26-15-7-3-5-13-6-4-10-24-18(13)15/h3-12,26H,1-2H3,(H,25,27)
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| InChIKey |
PBEGIKSTPQUSHW-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