General Information of the Compound
| Compound ID |
CP0035190
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| Compound Name |
2-[4-[(E)-2-phenylethenyl]phenyl]isoindole-1,3-dione
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| Structure |
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| Formula |
C22H15NO2
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| Molecular Weight |
325.367
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| Canonical SMILES |
O=C1N(C(=O)c2ccccc12)c1ccc(\C=C\c2ccccc2)cc1
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| InChI |
InChI=1S/C22H15NO2/c24-21-19-8-4-5-9-20(19)22(25)23(21)18-14-12-17(13-15-18)11-10-16-6-2-1-3-7-16/h1-15H/b11-10+
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| InChIKey |
NTDZLFGRAUKENS-ZHACJKMWSA-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