General Information of the Compound
| Compound ID |
CP0374027
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| Compound Name |
1-(5-tert-butyl-2-methylpyrazol-3-yl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]naphthalen-1-yl]urea
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| Structure |
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| Formula |
C26H27N7O3
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| Molecular Weight |
485.548
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| Canonical SMILES |
Cn1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)n(C)c23)c2ccccc12)C(C)(C)C
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| InChI |
InChI=1S/C26H27N7O3/c1-26(2,3)20-14-21(33(5)31-20)29-24(34)28-17-10-11-18(16-9-7-6-8-15(16)17)36-19-12-13-27-23-22(19)32(4)25(35)30-23/h6-14H,1-5H3,(H,27,30,35)(H2,28,29,34)
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| InChIKey |
MDSOZSMYMNLAET-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