General Information of the Compound
| Compound ID |
CP0483851
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| Compound Name |
US9012443, 355
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| Structure |
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| Formula |
C24H16F2N4O3S2
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| Molecular Weight |
510.547
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| Canonical SMILES |
COc1cc(ccc1-c1nccc2cc(ccc12)S(=O)(=O)Nc1nncs1)-c1cc(F)cc(F)c1
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| InChI |
InChI=1S/C24H16F2N4O3S2/c1-33-22-11-14(16-8-17(25)12-18(26)9-16)2-4-21(22)23-20-5-3-19(10-15(20)6-7-27-23)35(31,32)30-24-29-28-13-34-24/h2-13H,1H3,(H,29,30)
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| InChIKey |
VFHKNLPMWZUPFI-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