General Information of the Compound
| Compound ID |
CP0162110
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| Compound Name |
4-(azetidin-3-ylmethylamino)-5-chloro-2-fluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide
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| Structure |
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| Formula |
C13H14ClFN4O2S2
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| Molecular Weight |
376.866
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| Canonical SMILES |
Fc1cc(NCC2CNC2)c(Cl)cc1S(=O)(=O)Nc1nccs1
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| InChI |
InChI=1S/C13H14ClFN4O2S2/c14-9-3-12(23(20,21)19-13-17-1-2-22-13)10(15)4-11(9)18-7-8-5-16-6-8/h1-4,8,16,18H,5-7H2,(H,17,19)
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| InChIKey |
UJNZKASOHZSXKG-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