General Information of the Compound
| Compound ID |
CP0890249
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| Compound Name |
(E)-6-(3,4-Dimethoxyphenyl)4-oxohex-5-enoic acid piperedinamide
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| Structure |
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| Formula |
C19H25NO4
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| Molecular Weight |
331.412
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| Canonical SMILES |
COc1ccc(/C=C/C(=O)CCC(=O)N2CCCCC2)cc1OC
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| InChI |
InChI=1S/C19H25NO4/c1-23-17-10-7-15(14-18(17)24-2)6-8-16(21)9-11-19(22)20-12-4-3-5-13-20/h6-8,10,14H,3-5,9,11-13H2,1-2H3/b8-6+
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| InChIKey |
PPMHQBISMUKOLP-SOFGYWHQSA-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