General Information of the Compound
| Compound ID |
CP0850331
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| Compound Name |
2-ethoxy-N-(3-oxo-3-(3-(trifluoromethylsulfonyl)phenylamino)propyl)benzamide
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| Structure |
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| Formula |
C19H19F3N2O5S
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| Molecular Weight |
444.431
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| Canonical SMILES |
CCOc1ccccc1C(=O)NCCC(=O)Nc1cccc(S(=O)(=O)C(F)(F)F)c1
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| InChI |
InChI=1S/C19H19F3N2O5S/c1-2-29-16-9-4-3-8-15(16)18(26)23-11-10-17(25)24-13-6-5-7-14(12-13)30(27,28)19(20,21)22/h3-9,12H,2,10-11H2,1H3,(H,23,26)(H,24,25)
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| InChIKey |
DUQHXONJPUNVQL-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