General Information of the Compound
| Compound ID |
CP0461733
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| Compound Name |
11-(2-hexyl-5-hydroxyphenoxy)undecanoic acid (4-hydroxyphenyl)amide
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| Structure |
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| Formula |
C29H43NO4
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| Molecular Weight |
469.666
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| Canonical SMILES |
CCCCCCc1ccc(O)cc1OCCCCCCCCCCC(=O)Nc1ccc(O)cc1
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| InChI |
InChI=1S/C29H43NO4/c1-2-3-4-11-14-24-16-19-27(32)23-28(24)34-22-13-10-8-6-5-7-9-12-15-29(33)30-25-17-20-26(31)21-18-25/h16-21,23,31-32H,2-15,22H2,1H3,(H,30,33)
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| InChIKey |
SBZUBYZOOZUSIW-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