General Information of the Compound
| Compound ID |
CP0156553
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| Compound Name |
4,5,6,7-Tetrachloro-N-{3-[2-(4-methoxyphenyl)ethyl]phenyl}phthalimide
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| Structure |
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| Formula |
C23H15Cl4NO3
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| Molecular Weight |
495.189
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| Canonical SMILES |
COc1ccc(CCc2cccc(c2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1
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| InChI |
InChI=1S/C23H15Cl4NO3/c1-31-15-9-7-12(8-10-15)5-6-13-3-2-4-14(11-13)28-22(29)16-17(23(28)30)19(25)21(27)20(26)18(16)24/h2-4,7-11H,5-6H2,1H3
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| InChIKey |
XXNGDPQKHJDHDN-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