General Information of the Compound
| Compound ID |
CP0537941
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| Compound Name |
3-(2,3-Difluorophenyl)-1-methyl-N-(methylsulfonyl)-1H-indole-6-carboxamide
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| Structure |
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| Formula |
C17H14F2N2O3S
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| Molecular Weight |
364.373
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| Canonical SMILES |
Cn1cc(-c2cccc(F)c2F)c2ccc(cc12)C(=O)NS(C)(=O)=O
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| InChI |
InChI=1S/C17H14F2N2O3S/c1-21-9-13(12-4-3-5-14(18)16(12)19)11-7-6-10(8-15(11)21)17(22)20-25(2,23)24/h3-9H,1-2H3,(H,20,22)
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| InChIKey |
XBOOMOJPCVTGEG-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
Protein ID: PT01105, Sodium channel protein type 5 subunit alpha
Protein ID: PT01000, Sodium channel protein type 9 subunit alpha