General Information of the Compound
| Compound ID |
CP0405519
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| Compound Name |
16-(3-hydroxyphenoxy)hexadecanoic acid (4-hydroxyphenyl)amide
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| Structure |
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| Formula |
C28H41NO4
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| Molecular Weight |
455.639
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| Canonical SMILES |
Oc1ccc(NC(=O)CCCCCCCCCCCCCCCOc2cccc(O)c2)cc1
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| InChI |
InChI=1S/C28H41NO4/c30-25-20-18-24(19-21-25)29-28(32)17-12-10-8-6-4-2-1-3-5-7-9-11-13-22-33-27-16-14-15-26(31)23-27/h14-16,18-21,23,30-31H,1-13,17,22H2,(H,29,32)
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| InChIKey |
LBMZOGXFQCYTOA-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