General Information of the Compound
| Compound ID |
CP0548828
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| Compound Name |
8-[3-methoxy-5-(2-methyloctan-2-yl)phenoxy]-N-prop-2-enyloctanamide
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| Structure |
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| Formula |
C27H45NO3
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| Molecular Weight |
431.661
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| Canonical SMILES |
CCCCCCC(C)(C)c1cc(OC)cc(OCCCCCCCC(=O)NCC=C)c1
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| InChI |
InChI=1S/C27H45NO3/c1-6-8-9-14-17-27(3,4)23-20-24(30-5)22-25(21-23)31-19-15-12-10-11-13-16-26(29)28-18-7-2/h7,20-22H,2,6,8-19H2,1,3-5H3,(H,28,29)
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| InChIKey |
HRILJFPQDYTDSM-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