General Information of the Compound
| Compound ID |
CP0161611
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| Compound Name |
4,5,6,7-Tetrachloro-N-{2-[2-(3, 4-dimethoxyphenyl)ethyl]phenyl}phthalimide
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| Structure |
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| Formula |
C24H17Cl4NO4
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| Molecular Weight |
525.215
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| Canonical SMILES |
COc1ccc(CCc2ccccc2N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1OC
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| InChI |
InChI=1S/C24H17Cl4NO4/c1-32-15-10-8-12(11-16(15)33-2)7-9-13-5-3-4-6-14(13)29-23(30)17-18(24(29)31)20(26)22(28)21(27)19(17)25/h3-6,8,10-11H,7,9H2,1-2H3
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| InChIKey |
UROSCDVZSHWIDU-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