General Information of the Compound
| Compound ID |
CP0469872
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| Compound Name |
N-cyclopropyl-11-(3-pentyl-5-propan-2-yloxyphenoxy)undecanamide
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| Structure |
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| Formula |
C28H47NO3
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| Molecular Weight |
445.688
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| Canonical SMILES |
CCCCCc1cc(OCCCCCCCCCCC(=O)NC2CC2)cc(OC(C)C)c1
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| InChI |
InChI=1S/C28H47NO3/c1-4-5-12-15-24-20-26(22-27(21-24)32-23(2)3)31-19-14-11-9-7-6-8-10-13-16-28(30)29-25-17-18-25/h20-23,25H,4-19H2,1-3H3,(H,29,30)
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| InChIKey |
UNJTZCBUUXFOBZ-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