General Information of the Compound
| Compound ID |
CP0506106
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| Compound Name |
N-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-4,6-dioxo-5H-1,5-naphthyridine-3-carboxamide
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| Structure |
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| Formula |
C22H13F4N3O3
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| Molecular Weight |
443.356
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| Canonical SMILES |
Fc1cccc(F)c1Cn1cc(C(=O)Nc2c(F)cccc2F)c(=O)c2[nH]c(=O)ccc12
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| InChI |
InChI=1S/C22H13F4N3O3/c23-13-3-1-4-14(24)11(13)9-29-10-12(21(31)20-17(29)7-8-18(30)27-20)22(32)28-19-15(25)5-2-6-16(19)26/h1-8,10H,9H2,(H,27,30)(H,28,32)
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| InChIKey |
RWQXQRRRENGJOD-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