General Information of the Compound
| Compound ID |
CP0407366
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| Compound Name |
US9346798, 112
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| Structure |
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| Formula |
C20H21N3O3S2
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| Molecular Weight |
415.54
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| Canonical SMILES |
CC(C)c1ccc(cc1)N1CCOc2cc(ccc12)S(=O)(=O)Nc1nccs1
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| InChI |
InChI=1S/C20H21N3O3S2/c1-14(2)15-3-5-16(6-4-15)23-10-11-26-19-13-17(7-8-18(19)23)28(24,25)22-20-21-9-12-27-20/h3-9,12-14H,10-11H2,1-2H3,(H,21,22)
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| InChIKey |
WJMLJHPAHULJDS-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