General Information of the Compound
| Compound ID |
CP0195797
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| Compound Name |
2-Bromo-4-(4-fluoro-phenyl)-3-(4-methanesulfonyl-phenyl)-thiophene
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| Structure |
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| Formula |
C17H12BrFO2S2
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| Molecular Weight |
411.317
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| Canonical SMILES |
CS(=O)(=O)c1ccc(cc1)-c1c(Br)scc1-c1ccc(F)cc1
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| InChI |
InChI=1S/C17H12BrFO2S2/c1-23(20,21)14-8-4-12(5-9-14)16-15(10-22-17(16)18)11-2-6-13(19)7-3-11/h2-10H,1H3
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| InChIKey |
LJHFFRGTFPFMNK-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