General Information of the Compound
| Compound ID |
CP0963586
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| Compound Name |
N-benzyl-3-((2-chloro-4-(trifluoromethyl)phenoxy)methyl)benzamide
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| Structure |
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| Formula |
C22H17ClF3NO2
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| Molecular Weight |
419.83
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| Canonical SMILES |
O=C(NCc1ccccc1)c1cccc(COc2ccc(C(F)(F)F)cc2Cl)c1
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| InChI |
InChI=1S/C22H17ClF3NO2/c23-19-12-18(22(24,25)26)9-10-20(19)29-14-16-7-4-8-17(11-16)21(28)27-13-15-5-2-1-3-6-15/h1-12H,13-14H2,(H,27,28)
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| InChIKey |
LESMBUJYQBPRGA-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