General Information of the Compound
| Compound ID |
CP0410859
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| Compound Name |
3-pentyl-5-[11-(prop-2-enylamino)undecoxy]phenol
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| Structure |
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| Formula |
C25H43NO2
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| Molecular Weight |
389.624
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| Canonical SMILES |
CCCCCc1cc(O)cc(OCCCCCCCCCCCNCC=C)c1
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| InChI |
InChI=1S/C25H43NO2/c1-3-5-13-16-23-20-24(27)22-25(21-23)28-19-15-12-10-8-6-7-9-11-14-18-26-17-4-2/h4,20-22,26-27H,2-3,5-19H2,1H3
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| InChIKey |
GEAPPRKVLAAFQO-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