General Information of the Compound
| Compound ID |
CP0846987
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| Compound Name |
2-ethyl-5-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)penta-2,4-dienamido)acetate
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| Structure |
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| Formula |
C17H19NO5
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| Molecular Weight |
317.341
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| Canonical SMILES |
CCOC(=O)CNC(=O)/C=C/C=C/c1ccc2c(c1)OCCO2
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| InChI |
InChI=1S/C17H19NO5/c1-2-21-17(20)12-18-16(19)6-4-3-5-13-7-8-14-15(11-13)23-10-9-22-14/h3-8,11H,2,9-10,12H2,1H3,(H,18,19)/b5-3+,6-4+
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| InChIKey |
NDBQYKYBJSDAAH-GGWOSOGESA-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