General Information of the Compound
| Compound ID |
CP0415612
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| Compound Name |
(+/-)-4,4'-(2-(prop-1-en-2-yl)propane-1,3-diyl)bis(methylbenzene)
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| Structure |
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| Formula |
C15H12Cl2O3
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| Molecular Weight |
311.164
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| Canonical SMILES |
OC(=O)C(Cc1ccc(Cl)cc1)Oc1ccc(Cl)cc1
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| InChI |
InChI=1S/C15H12Cl2O3/c16-11-3-1-10(2-4-11)9-14(15(18)19)20-13-7-5-12(17)6-8-13/h1-8,14H,9H2,(H,18,19)
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| InChIKey |
LWTCEQHBTMPRBZ-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: PT00910, Peroxisome proliferator-activated receptor alpha
Protein ID: PT00915, Peroxisome proliferator-activated receptor gamma