General Information of the Compound
| Compound ID |
CP0455069
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| Compound Name |
2-(4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2H-1,2,3-triazol-2-yl)-N-(2-fluorobenzyl)acetamide
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| Structure |
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| Formula |
C23H16Cl3FN4O
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| Molecular Weight |
489.765
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| Canonical SMILES |
Fc1ccccc1CNC(=O)Cn1nc(c(n1)-c1ccc(Cl)cc1Cl)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C23H16Cl3FN4O/c24-16-7-5-14(6-8-16)22-23(18-10-9-17(25)11-19(18)26)30-31(29-22)13-21(32)28-12-15-3-1-2-4-20(15)27/h1-11H,12-13H2,(H,28,32)
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| InChIKey |
GXBHQIVODVYSBM-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