General Information of the Compound
| Compound ID |
CP0504010
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| Compound Name |
1-(3-tert-butylphenyl)-3-[4-[(3-methyl-2-oxo-1H-imidazo[4,5-b]pyridin-7-yl)oxy]naphthalen-1-yl]urea
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| Structure |
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| Formula |
C28H27N5O3
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| Molecular Weight |
481.556
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| Canonical SMILES |
Cn1c2nccc(Oc3ccc(NC(=O)Nc4cccc(c4)C(C)(C)C)c4ccccc34)c2[nH]c1=O
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| InChI |
InChI=1S/C28H27N5O3/c1-28(2,3)17-8-7-9-18(16-17)30-26(34)31-21-12-13-22(20-11-6-5-10-19(20)21)36-23-14-15-29-25-24(23)32-27(35)33(25)4/h5-16H,1-4H3,(H,32,35)(H2,30,31,34)
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| InChIKey |
QZPJMEVVSVOMMR-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