General Information of the Compound
| Compound ID |
CP0433336
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| Compound Name |
1-[4-(trifluoromethoxy)phenyl]-3-[2-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]urea
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| Structure |
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| Formula |
C20H13F6N3O3
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| Molecular Weight |
457.33
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| Canonical SMILES |
FC(F)(F)Oc1ccc(NC(=O)Nc2cccnc2Oc2cccc(c2)C(F)(F)F)cc1
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| InChI |
InChI=1S/C20H13F6N3O3/c21-19(22,23)12-3-1-4-15(11-12)31-17-16(5-2-10-27-17)29-18(30)28-13-6-8-14(9-7-13)32-20(24,25)26/h1-11H,(H2,28,29,30)
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| InChIKey |
PNXLVUJREGGRTO-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