General Information of the Compound
| Compound ID |
CP0566186
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| Compound Name |
2-methyl-N-[4-[[5-methyl-4-[4-(trifluoromethoxy)phenyl]pyrimidin-2-yl]amino]phenyl]benzamide
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| Structure |
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| Formula |
C26H21F3N4O2
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| Molecular Weight |
478.474
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| Canonical SMILES |
Cc1ccccc1C(=O)Nc1ccc(Nc2ncc(C)c(n2)-c2ccc(OC(F)(F)F)cc2)cc1
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| InChI |
InChI=1S/C26H21F3N4O2/c1-16-5-3-4-6-22(16)24(34)31-19-9-11-20(12-10-19)32-25-30-15-17(2)23(33-25)18-7-13-21(14-8-18)35-26(27,28)29/h3-15H,1-2H3,(H,31,34)(H,30,32,33)
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| InChIKey |
YAAWKGXZQKNINY-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