General Information of the Compound
| Compound ID |
CP0507515
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| Compound Name |
1-[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]-3-[4-[(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-7-yl)oxy]phenyl]urea
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| Structure |
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| Formula |
C26H24ClN7O3
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| Molecular Weight |
517.977
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| Canonical SMILES |
CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)[nH]c34)cc2)n(n1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C26H24ClN7O3/c1-26(2,3)20-14-21(34(33-20)17-8-4-15(27)5-9-17)30-24(35)29-16-6-10-18(11-7-16)37-19-12-13-28-23-22(19)31-25(36)32-23/h4-14H,1-3H3,(H2,29,30,35)(H2,28,31,32,36)
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| InChIKey |
GFFLQYGZLSHKDU-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