General Information of the Compound
| Compound ID |
CP0402675
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| Compound Name |
US9346798, 73
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| Structure |
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| Formula |
C21H18N4O3S2
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| Molecular Weight |
438.534
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| Canonical SMILES |
Cc1ccc2cnccc2c1N1CCOc2cc(ccc12)S(=O)(=O)Nc1nccs1
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| InChI |
InChI=1S/C21H18N4O3S2/c1-14-2-3-15-13-22-7-6-17(15)20(14)25-9-10-28-19-12-16(4-5-18(19)25)30(26,27)24-21-23-8-11-29-21/h2-8,11-13H,9-10H2,1H3,(H,23,24)
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| InChIKey |
LHEOWNKLIIFUNR-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