General Information of the Compound
| Compound ID |
CP0391732
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| Compound Name |
N-(4-fluorophenyl)-1-oxido-6-propan-2-ylsulfonylpyridin-1-ium-3-carboxamide
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| Structure |
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| Formula |
C15H15FN2O4S
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| Molecular Weight |
338.36
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| Canonical SMILES |
CC(C)S(=O)(=O)c1ccc(c[n+]1[O-])C(=O)Nc1ccc(F)cc1
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| InChI |
InChI=1S/C15H15FN2O4S/c1-10(2)23(21,22)14-8-3-11(9-18(14)20)15(19)17-13-6-4-12(16)5-7-13/h3-10H,1-2H3,(H,17,19)
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| InChIKey |
BDHFKXHNMQPNQB-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