General Information of the Compound
| Compound ID |
CP0469874
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| Compound Name |
N-(cyclopropylmethyl)-11-[3-methoxy-5-(2-methyloctan-2-yl)phenoxy]undecanamide
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| Structure |
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| Formula |
C31H53NO3
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| Molecular Weight |
487.769
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| Canonical SMILES |
CCCCCCC(C)(C)c1cc(OC)cc(OCCCCCCCCCCC(=O)NCC2CC2)c1
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| InChI |
InChI=1S/C31H53NO3/c1-5-6-7-15-20-31(2,3)27-22-28(34-4)24-29(23-27)35-21-16-13-11-9-8-10-12-14-17-30(33)32-25-26-18-19-26/h22-24,26H,5-21,25H2,1-4H3,(H,32,33)
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| InChIKey |
ZDPDSOSJYHXBSZ-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