General Information of the Compound
| Compound ID |
CP0858816
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| Compound Name |
(E)-7-Naphthalen-2-yl-5-oxohept-6-enoic piperidinamide
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| Structure |
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| Formula |
C22H25NO2
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| Molecular Weight |
335.447
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| Canonical SMILES |
O=C(/C=C/c1ccc2ccccc2c1)CCCC(=O)N1CCCCC1
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| InChI |
InChI=1S/C22H25NO2/c24-21(9-6-10-22(25)23-15-4-1-5-16-23)14-12-18-11-13-19-7-2-3-8-20(19)17-18/h2-3,7-8,11-14,17H,1,4-6,9-10,15-16H2/b14-12+
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| InChIKey |
ITECAINUXYCJRB-WYMLVPIESA-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