General Information of the Compound
| Compound ID |
CP0461735
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| Compound Name |
6-(2-hexyl-5-hydroxyphenoxy)hexanoic acid (2-hydroxyethyl)amide
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| Structure |
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| Formula |
C20H33NO4
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| Molecular Weight |
351.487
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| Canonical SMILES |
CCCCCCc1ccc(O)cc1OCCCCCC(=O)NCCO
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| InChI |
InChI=1S/C20H33NO4/c1-2-3-4-6-9-17-11-12-18(23)16-19(17)25-15-8-5-7-10-20(24)21-13-14-22/h11-12,16,22-23H,2-10,13-15H2,1H3,(H,21,24)
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| InChIKey |
NGIJVMLOULTUEK-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