General Information of the Compound
| Compound ID |
CP0497896
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| Compound Name |
US9346798, 78
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| Structure |
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| Formula |
C18H16FN3O3S2
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| Molecular Weight |
405.476
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| Canonical SMILES |
Cc1c(F)cccc1N1CCOc2cc(ccc12)S(=O)(=O)Nc1nccs1
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| InChI |
InChI=1S/C18H16FN3O3S2/c1-12-14(19)3-2-4-15(12)22-8-9-25-17-11-13(5-6-16(17)22)27(23,24)21-18-20-7-10-26-18/h2-7,10-11H,8-9H2,1H3,(H,20,21)
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| InChIKey |
NUASSICUZKIENU-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