General Information of the Compound
| Compound ID |
CP0440290
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| Compound Name |
1-[(4-fluorophenyl)methyl]-N-(4-morpholin-4-ylphenyl)-4,6-dioxo-5H-1,5-naphthyridine-3-carboxamide
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| Structure |
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| Formula |
C26H23FN4O4
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| Molecular Weight |
474.492
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| Canonical SMILES |
Fc1ccc(Cn2cc(C(=O)Nc3ccc(cc3)N3CCOCC3)c(=O)c3[nH]c(=O)ccc23)cc1
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| InChI |
InChI=1S/C26H23FN4O4/c27-18-3-1-17(2-4-18)15-31-16-21(25(33)24-22(31)9-10-23(32)29-24)26(34)28-19-5-7-20(8-6-19)30-11-13-35-14-12-30/h1-10,16H,11-15H2,(H,28,34)(H,29,32)
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| InChIKey |
CEYYQGHFPVAQLG-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