General Information of the Compound
| Compound ID |
CP0388774
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| Compound Name |
2-(4,5-bis(2,4-dichlorophenyl)-2H-1,2,3-triazol-2-yl)-N-(4-chlorobenzyl)acetamide
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| Structure |
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| Formula |
C23H15Cl5N4O
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| Molecular Weight |
540.665
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| Canonical SMILES |
Clc1ccc(CNC(=O)Cn2nc(c(n2)-c2ccc(Cl)cc2Cl)-c2ccc(Cl)cc2Cl)cc1
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| InChI |
InChI=1S/C23H15Cl5N4O/c24-14-3-1-13(2-4-14)11-29-21(33)12-32-30-22(17-7-5-15(25)9-19(17)27)23(31-32)18-8-6-16(26)10-20(18)28/h1-10H,11-12H2,(H,29,33)
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| InChIKey |
NEGKWBFVVPQGGS-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