General Information of the Compound
| Compound ID |
CP0866863
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| Compound Name |
3-(4-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-di-n-propylphenoxy)-butyl)-1,5,5-trimethylimidazolidine-2,4-dione
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| Structure |
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| Formula |
C25H34F6N2O4
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| Molecular Weight |
540.545
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| Canonical SMILES |
CCCc1cc(C(O)(C(F)(F)F)C(F)(F)F)cc(CCC)c1OCCCCN1C(=O)N(C)C(C)(C)C1=O
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| InChI |
InChI=1S/C25H34F6N2O4/c1-6-10-16-14-18(23(36,24(26,27)28)25(29,30)31)15-17(11-7-2)19(16)37-13-9-8-12-33-20(34)22(3,4)32(5)21(33)35/h14-15,36H,6-13H2,1-5H3
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| InChIKey |
VCQICRASEKZXNI-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