General Information of the Compound
| Compound ID |
CP0483852
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| Compound Name |
US9012443, 361
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| Structure |
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| Formula |
C24H24N4O4S
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| Molecular Weight |
464.547
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| Canonical SMILES |
COc1cc(OCC(C)C)ccc1-c1nccc2cc(ccc12)S(=O)(=O)Nc1ccncn1
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| InChI |
InChI=1S/C24H24N4O4S/c1-16(2)14-32-18-4-6-21(22(13-18)31-3)24-20-7-5-19(12-17(20)8-11-26-24)33(29,30)28-23-9-10-25-15-27-23/h4-13,15-16H,14H2,1-3H3,(H,25,27,28)
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| InChIKey |
IININTSZAMXOMH-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