General Information of the Compound
| Compound ID |
CP0415487
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| Compound Name |
(2-ethyl-1-benzothiophen-3-yl)-(4-methoxyphenyl)methanone
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| Structure |
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| Formula |
C18H16O2S
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| Molecular Weight |
296.391
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| Canonical SMILES |
CCc1sc2ccccc2c1C(=O)c1ccc(OC)cc1
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| InChI |
InChI=1S/C18H16O2S/c1-3-15-17(14-6-4-5-7-16(14)21-15)18(19)12-8-10-13(20-2)11-9-12/h4-11H,3H2,1-2H3
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| InChIKey |
OAKRXGHCBOVQLB-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