General Information of the Compound
| Compound ID |
CP0522106
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| Compound Name |
N-[4-(5-cyano-1-methylpyrrol-2-yl)-3-(trifluoromethyl)phenyl]ethanesulfonamide
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| Structure |
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| Formula |
C15H14F3N3O2S
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| Molecular Weight |
357.357
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| Canonical SMILES |
CCS(=O)(=O)Nc1ccc(-c2ccc(C#N)n2C)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C15H14F3N3O2S/c1-3-24(22,23)20-10-4-6-12(13(8-10)15(16,17)18)14-7-5-11(9-19)21(14)2/h4-8,20H,3H2,1-2H3
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| InChIKey |
MZUYPFIOEIBRRF-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