General Information of the Compound
| Compound ID |
CP0540802
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| Compound Name |
US9079902, 42
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| Structure |
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| Formula |
C16H15N5O3S2
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| Molecular Weight |
389.462
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| Canonical SMILES |
Cc1noc(C)c1-c1cn(C)c2cc(ccc12)S(=O)(=O)Nc1ncns1
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| InChI |
InChI=1S/C16H15N5O3S2/c1-9-15(10(2)24-19-9)13-7-21(3)14-6-11(4-5-12(13)14)26(22,23)20-16-17-8-18-25-16/h4-8H,1-3H3,(H,17,18,20)
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| InChIKey |
YQWSACSHCYOHJR-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