General Information of the Compound
| Compound ID |
CP0567125
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| Compound Name |
2-methyl-N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-4-[5-(trifluoromethyl)pyridin-2-yl]oxybenzamide
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| Structure |
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| Formula |
C26H26BF3N2O4
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| Molecular Weight |
498.31
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| Canonical SMILES |
Cc1cc(Oc2ccc(cn2)C(F)(F)F)ccc1C(=O)Nc1ccccc1B1OC(C)(C)C(C)(C)O1
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| InChI |
InChI=1S/C26H26BF3N2O4/c1-16-14-18(34-22-13-10-17(15-31-22)26(28,29)30)11-12-19(16)23(33)32-21-9-7-6-8-20(21)27-35-24(2,3)25(4,5)36-27/h6-15H,1-5H3,(H,32,33)
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| InChIKey |
OXUMLBDODONKDO-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