General Information of the Compound
| Compound ID |
CP0523042
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| Compound Name |
2,6-difluoro-N-[3-[methyl(propyl)amino]-5-(trifluoromethyl)phenyl]benzamide
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| Structure |
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| Formula |
C18H17F5N2O
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| Molecular Weight |
372.337
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| Canonical SMILES |
CCCN(C)c1cc(NC(=O)c2c(F)cccc2F)cc(c1)C(F)(F)F
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| InChI |
InChI=1S/C18H17F5N2O/c1-3-7-25(2)13-9-11(18(21,22)23)8-12(10-13)24-17(26)16-14(19)5-4-6-15(16)20/h4-6,8-10H,3,7H2,1-2H3,(H,24,26)
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| InChIKey |
KDKWYYITVHNVKM-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