General Information of the Compound
| Compound ID |
CP0389198
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| Compound Name |
3-[4-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dipropylphenoxy]butyl]-5-methyl-5-[4-(trifluoromethoxy)phenyl]imidazolidine-2,4-dione
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| Structure |
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| Formula |
C30H33F9N2O5
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| Molecular Weight |
672.585
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| Canonical SMILES |
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OC(F)(F)F)cc1)C(O)(C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C30H33F9N2O5/c1-4-8-18-16-21(27(44,28(31,32)33)29(34,35)36)17-19(9-5-2)23(18)45-15-7-6-14-41-24(42)26(3,40-25(41)43)20-10-12-22(13-11-20)46-30(37,38)39/h10-13,16-17,44H,4-9,14-15H2,1-3H3,(H,40,43)
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| InChIKey |
SGCDSLHTYKBRQO-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