General Information of the Compound
| Compound ID |
CP0459279
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(4-morpholin-4-ylphenyl)-4,6-dioxo-1-[(2,3,5,6-tetrafluorophenyl)methyl]-5H-1,5-naphthyridine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H20F4N4O4
|
||||||||||||||||||
| Molecular Weight |
528.462
|
||||||||||||||||||
| Canonical SMILES |
Fc1cc(F)c(F)c(Cn2cc(C(=O)Nc3ccc(cc3)N3CCOCC3)c(=O)c3[nH]c(=O)ccc23)c1F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H20F4N4O4/c27-18-11-19(28)23(30)16(22(18)29)12-34-13-17(25(36)24-20(34)5-6-21(35)32-24)26(37)31-14-1-3-15(4-2-14)33-7-9-38-10-8-33/h1-6,11,13H,7-10,12H2,(H,31,37)(H,32,35)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CGIXDAAVAHVYMW-UHFFFAOYSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
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