General Information of the Compound
| Compound ID |
CP0434768
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| Compound Name |
2-[2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]isoindole-1,3-dione
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| Structure |
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| Formula |
C23H17NO2
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| Molecular Weight |
339.394
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| Canonical SMILES |
Cc1ccccc1\C=C\c1ccccc1N1C(=O)c2ccccc2C1=O
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| InChI |
InChI=1S/C23H17NO2/c1-16-8-2-3-9-17(16)14-15-18-10-4-7-13-21(18)24-22(25)19-11-5-6-12-20(19)23(24)26/h2-15H,1H3/b15-14+
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| InChIKey |
UEONABXRMRCAQU-CCEZHUSRSA-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