General Information of the Compound
| Compound ID |
CP0533372
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| Compound Name |
2-chloro-6-fluoro-N-[4-[3-(trifluoromethyl)phenoxy]phenyl]benzamide
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| Structure |
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| Formula |
C20H12ClF4NO2
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| Molecular Weight |
409.766
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| Canonical SMILES |
Fc1cccc(Cl)c1C(=O)Nc1ccc(Oc2cccc(c2)C(F)(F)F)cc1
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| InChI |
InChI=1S/C20H12ClF4NO2/c21-16-5-2-6-17(22)18(16)19(27)26-13-7-9-14(10-8-13)28-15-4-1-3-12(11-15)20(23,24)25/h1-11H,(H,26,27)
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| InChIKey |
VGKKFQGJRISWMS-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: PT02160, Toll-like receptor 7
Protein ID: PT02546, Toll-like receptor 8