General Information of the Compound
Compound ID |
CP0375724
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Compound Name |
US9079902, 62
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Structure |
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Formula |
C19H14ClN7O2S2
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Molecular Weight |
471.955
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Canonical SMILES |
Cn1nccc1-c1cc(Cl)ccc1-n1cnc2cc(ccc12)S(=O)(=O)Nc1ncns1
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InChI |
InChI=1S/C19H14ClN7O2S2/c1-26-16(6-7-23-26)14-8-12(20)2-4-17(14)27-11-22-15-9-13(3-5-18(15)27)31(28,29)25-19-21-10-24-30-19/h2-11H,1H3,(H,21,24,25)
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InChIKey |
ZHLLLELDBGEMDV-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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