General Information of the Compound
| Compound ID |
CP0198482
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| Compound Name |
5-((5-Chloropyridin-3-yl)oxy)-4-(difluoromethyl)- 2,2-difluoro-3-hydroxy-2,3- dihydrobenzo[b]thiophene 1,1-dioxide
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| Structure |
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| Formula |
C14H8ClF4NO4S
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| Molecular Weight |
397.733
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| Canonical SMILES |
OC1c2c(ccc(Oc3cncc(Cl)c3)c2C(F)F)S(=O)(=O)C1(F)F
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| InChI |
InChI=1S/C14H8ClF4NO4S/c15-6-3-7(5-20-4-6)24-8-1-2-9-11(10(8)13(16)17)12(21)14(18,19)25(9,22)23/h1-5,12-13,21H
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| InChIKey |
WGJHLXZAYOERQG-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