General Information of the Compound
| Compound ID |
CP0474781
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| Compound Name |
US9079902, 51
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| Structure |
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| Formula |
C16H12ClN5O2S2
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| Molecular Weight |
405.892
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| Canonical SMILES |
Cn1cc(-c2ccncc2Cl)c2ccc(cc12)S(=O)(=O)Nc1ncns1
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| InChI |
InChI=1S/C16H12ClN5O2S2/c1-22-8-13(11-4-5-18-7-14(11)17)12-3-2-10(6-15(12)22)26(23,24)21-16-19-9-20-25-16/h2-9H,1H3,(H,19,20,21)
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| InChIKey |
STIRYLQMNOJPPF-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