General Information of the Compound
| Compound ID |
CP0545856
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| Compound Name |
6-[[[1-[2-(6-methoxyquinolin-4-yl)ethyl]piperidin-4-yl]amino]methyl]-4H-pyrido[3,2-b][1,4]oxazin-3-one
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| Structure |
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| Formula |
C25H29N5O3
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| Molecular Weight |
447.539
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| Canonical SMILES |
COc1ccc2nccc(CCN3CCC(CC3)NCc3ccc4OCC(=O)Nc4n3)c2c1
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| InChI |
InChI=1S/C25H29N5O3/c1-32-20-3-4-22-21(14-20)17(6-10-26-22)7-11-30-12-8-18(9-13-30)27-15-19-2-5-23-25(28-19)29-24(31)16-33-23/h2-6,10,14,18,27H,7-9,11-13,15-16H2,1H3,(H,28,29,31)
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| InChIKey |
WJLRERCERXYTCN-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