General Information of the Compound
| Compound ID |
CP0432794
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| Compound Name |
2-[10-(4-hexyl-3-hydroxyphenoxy)decoxy]propane-1,3-diol
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| Structure |
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| Formula |
C25H44O5
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| Molecular Weight |
424.622
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| Canonical SMILES |
CCCCCCc1ccc(OCCCCCCCCCCOC(CO)CO)cc1O
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| InChI |
InChI=1S/C25H44O5/c1-2-3-4-11-14-22-15-16-23(19-25(22)28)29-17-12-9-7-5-6-8-10-13-18-30-24(20-26)21-27/h15-16,19,24,26-28H,2-14,17-18,20-21H2,1H3
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| InChIKey |
JRGWZPOVHWFIFJ-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: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2