General Information of the Compound
| Compound ID |
CP0423228
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| Compound Name |
4-(4-chlorophenyl)-3-(3,4-difluorophenyl)sulfonyl-7-fluoroquinoline
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| Structure |
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| Formula |
C21H11ClF3NO2S
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| Molecular Weight |
433.838
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| Canonical SMILES |
Fc1ccc2c(-c3ccc(Cl)cc3)c(cnc2c1)S(=O)(=O)c1ccc(F)c(F)c1
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| InChI |
InChI=1S/C21H11ClF3NO2S/c22-13-3-1-12(2-4-13)21-16-7-5-14(23)9-19(16)26-11-20(21)29(27,28)15-6-8-17(24)18(25)10-15/h1-11H
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| InChIKey |
HXNBGBOZDFURTH-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