General Information of the Compound
| Compound ID |
CP0311740
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| Compound Name |
1,1,1-trifluoro-2-[4-[2-(4-fluorophenyl)phenyl]sulfonylphenyl]propan-2-ol
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| Structure |
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| Formula |
C21H16F4O3S
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| Molecular Weight |
424.415
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| Canonical SMILES |
CC(O)(c1ccc(cc1)S(=O)(=O)c1ccccc1-c1ccc(F)cc1)C(F)(F)F
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| InChI |
InChI=1S/C21H16F4O3S/c1-20(26,21(23,24)25)15-8-12-17(13-9-15)29(27,28)19-5-3-2-4-18(19)14-6-10-16(22)11-7-14/h2-13,26H,1H3
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| InChIKey |
DOPRCGPCIUXMCJ-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