General Information of the Compound
| Compound ID |
CP0379532
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| Compound Name |
1-methyl-3-[4-[2-oxo-6,8-dipropyl-4-(trifluoromethyl)chromen-7-yl]oxybutyl]imidazolidine-2,4-dione
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| Structure |
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| Formula |
C24H29F3N2O5
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| Molecular Weight |
482.499
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| Canonical SMILES |
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)CN(C)C1=O)C(F)(F)F
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| InChI |
InChI=1S/C24H29F3N2O5/c1-4-8-15-12-17-18(24(25,26)27)13-20(31)34-22(17)16(9-5-2)21(15)33-11-7-6-10-29-19(30)14-28(3)23(29)32/h12-13H,4-11,14H2,1-3H3
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| InChIKey |
KANFQBHREKEGNX-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