General Information of the Compound
| Compound ID |
CP0541331
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| Compound Name |
2-[(2-ethoxybenzoyl)amino]-N-[3-(trifluoromethylsulfonyl)phenyl]thiophene-3-carboxamide
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| Structure |
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| Formula |
C21H17F3N2O5S2
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| Molecular Weight |
498.504
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| Canonical SMILES |
CCOc1ccccc1C(=O)Nc1sccc1C(=O)Nc1cccc(c1)S(=O)(=O)C(F)(F)F
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| InChI |
InChI=1S/C21H17F3N2O5S2/c1-2-31-17-9-4-3-8-15(17)18(27)26-20-16(10-11-32-20)19(28)25-13-6-5-7-14(12-13)33(29,30)21(22,23)24/h3-12H,2H2,1H3,(H,25,28)(H,26,27)
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| InChIKey |
RKKFLQWZFINRIZ-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