General Information of the Compound
| Compound ID |
CP0481327
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| Compound Name |
1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[3-fluoro-4-(6-piperidin-1-ylpyrimidin-4-yl)oxyphenyl]urea
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| Structure |
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| Formula |
C23H27FN6O3
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| Molecular Weight |
454.506
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| Canonical SMILES |
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3cc(ncn3)N3CCCCC3)c(F)c2)no1
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| InChI |
InChI=1S/C23H27FN6O3/c1-23(2,3)18-12-19(29-33-18)28-22(31)27-15-7-8-17(16(24)11-15)32-21-13-20(25-14-26-21)30-9-5-4-6-10-30/h7-8,11-14H,4-6,9-10H2,1-3H3,(H2,27,28,29,31)
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| InChIKey |
OEZKNJOTRJGSHY-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