General Information of the Compound
| Compound ID |
CP0446308
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| Compound Name |
2-[(2-ethoxybenzoyl)amino]-N-[3-(trifluoromethylsulfonyl)phenyl]pyridine-3-carboxamide
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| Structure |
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| Formula |
C22H18F3N3O5S
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| Molecular Weight |
493.463
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| Canonical SMILES |
CCOc1ccccc1C(=O)Nc1ncccc1C(=O)Nc1cccc(c1)S(=O)(=O)C(F)(F)F
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| InChI |
InChI=1S/C22H18F3N3O5S/c1-2-33-18-11-4-3-9-16(18)20(29)28-19-17(10-6-12-26-19)21(30)27-14-7-5-8-15(13-14)34(31,32)22(23,24)25/h3-13H,2H2,1H3,(H,27,30)(H,26,28,29)
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| InChIKey |
AESAYYDMRAGIAF-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