General Information of the Compound
| Compound ID |
CP0544945
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| Compound Name |
1,1,1,3,3,3-hexafluoro-2-[4-[3-hydroxypropyl(dimethyl)silyl]phenyl]propan-2-ol
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| Structure |
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| Formula |
C14H18F6O2Si
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| Molecular Weight |
360.37
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| Canonical SMILES |
C[Si](C)(CCCO)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C14H18F6O2Si/c1-23(2,9-3-8-21)11-6-4-10(5-7-11)12(22,13(15,16)17)14(18,19)20/h4-7,21-22H,3,8-9H2,1-2H3
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| InChIKey |
KNLLYRSQGRCDFQ-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: PT01555, Oxysterols receptor LXR-alpha
Protein ID: PT01887, Oxysterols receptor LXR-beta