General Information of the Compound
| Compound ID |
CP0512626
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| Compound Name |
US9012443, 532
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| Structure |
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| Formula |
C17H12ClN5O2S2
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| Molecular Weight |
417.903
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| Canonical SMILES |
Cc1cc(Cl)ccc1-c1ncnc2cc(ccc12)S(=O)(=O)Nc1ncns1
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| InChI |
InChI=1S/C17H12ClN5O2S2/c1-10-6-11(18)2-4-13(10)16-14-5-3-12(7-15(14)19-8-20-16)27(24,25)23-17-21-9-22-26-17/h2-9H,1H3,(H,21,22,23)
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| InChIKey |
SAAHVVLWBSOFDW-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