General Information of the Compound
| Compound ID |
CP0440838
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| Compound Name |
1-[(2,6-difluorophenyl)methyl]-6-methoxy-N-(4-morpholin-4-ylphenyl)-4-oxo-1,5-naphthyridine-3-carboxamide
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| Structure |
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| Formula |
C27H24F2N4O4
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| Molecular Weight |
506.509
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| Canonical SMILES |
COc1ccc2n(Cc3c(F)cccc3F)cc(C(=O)Nc3ccc(cc3)N3CCOCC3)c(=O)c2n1
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| InChI |
InChI=1S/C27H24F2N4O4/c1-36-24-10-9-23-25(31-24)26(34)20(16-33(23)15-19-21(28)3-2-4-22(19)29)27(35)30-17-5-7-18(8-6-17)32-11-13-37-14-12-32/h2-10,16H,11-15H2,1H3,(H,30,35)
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| InChIKey |
OKWBEFGFVXJFDV-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
Protein ID: PT01479, 3',5'-cyclic-AMP phosphodiesterase 4A
Protein ID: PT01728, High affinity 3',5'-cyclic-AMP phosphodiesterase 7A