General Information of the Compound
| Compound ID |
CP0485509
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| Compound Name |
US9346798, 119
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| Structure |
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| Formula |
C19H19N3O5S2
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| Molecular Weight |
433.511
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| Canonical SMILES |
COc1ccc(cc1OC)N1CCOc2cc(ccc12)S(=O)(=O)Nc1nccs1
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| InChI |
InChI=1S/C19H19N3O5S2/c1-25-16-6-3-13(11-18(16)26-2)22-8-9-27-17-12-14(4-5-15(17)22)29(23,24)21-19-20-7-10-28-19/h3-7,10-12H,8-9H2,1-2H3,(H,20,21)
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| InChIKey |
PCZYFTWNHASLMV-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