General Information of the Compound
| Compound ID |
CP0470692
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| Compound Name |
1-[2-fluoro-4-[3-(methylamino)pyrido[2,3-b]pyrazin-8-yl]oxyphenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea
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| Structure |
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| Formula |
C22H15F5N6O2
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| Molecular Weight |
490.392
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| Canonical SMILES |
CNc1cnc2c(Oc3ccc(NC(=O)Nc4cc(ccc4F)C(F)(F)F)c(F)c3)ccnc2n1
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| InChI |
InChI=1S/C22H15F5N6O2/c1-28-18-10-30-19-17(6-7-29-20(19)33-18)35-12-3-5-15(14(24)9-12)31-21(34)32-16-8-11(22(25,26)27)2-4-13(16)23/h2-10H,1H3,(H,28,29,33)(H2,31,32,34)
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| InChIKey |
UDNXYKVDZJLJST-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