General Information of the Compound
| Compound ID |
CP0372253
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| Compound Name |
4-(4-(2-aminopyridin-4-yloxy)-3-fluorophenylamino)-N-(2,4-difluorophenyl)-2-(dimethylamino)pyrimidine-5-carboxamide
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| Structure |
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| Formula |
C24H20F3N7O2
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| Molecular Weight |
495.465
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| Canonical SMILES |
CN(C)c1ncc(C(=O)Nc2ccc(F)cc2F)c(Nc2ccc(Oc3ccnc(N)c3)c(F)c2)n1
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| InChI |
InChI=1S/C24H20F3N7O2/c1-34(2)24-30-12-16(23(35)32-19-5-3-13(25)9-17(19)26)22(33-24)31-14-4-6-20(18(27)10-14)36-15-7-8-29-21(28)11-15/h3-12H,1-2H3,(H2,28,29)(H,32,35)(H,30,31,33)
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| InChIKey |
BIZAUQGRBCDFSE-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