General Information of the Compound
| Compound ID |
CP0327835
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| Compound Name |
[4-[4-[benzyl(methyl)amino]butoxy]phenyl]-[2-(4-methoxyphenyl)-1-benzofuran-3-yl]methanone
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| Structure |
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| Formula |
C34H33NO4
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| Molecular Weight |
519.641
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| Canonical SMILES |
COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(OCCCCN(C)Cc2ccccc2)cc1
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| InChI |
InChI=1S/C34H33NO4/c1-35(24-25-10-4-3-5-11-25)22-8-9-23-38-29-20-14-26(15-21-29)33(36)32-30-12-6-7-13-31(30)39-34(32)27-16-18-28(37-2)19-17-27/h3-7,10-21H,8-9,22-24H2,1-2H3
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| InChIKey |
SVNRMCMIMMJNDK-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