General Information of the Compound
| Compound ID |
CP0447617
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| Compound Name |
1-(5-tert-butyl-2-methylpyrazol-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 |
C21H23N7O3
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| Molecular Weight |
421.461
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| Canonical SMILES |
Cn1nc(cc1NC(=O)Nc1ccc(Oc2ccnc3[nH]c(=O)[nH]c23)cc1)C(C)(C)C
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| InChI |
InChI=1S/C21H23N7O3/c1-21(2,3)15-11-16(28(4)27-15)24-19(29)23-12-5-7-13(8-6-12)31-14-9-10-22-18-17(14)25-20(30)26-18/h5-11H,1-4H3,(H2,23,24,29)(H2,22,25,26,30)
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| InChIKey |
HXWDIWWSQLFGJI-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