General Information of the Compound
| Compound ID |
CP0432121
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[3-(1-amino-5-fluoro-3-methyl-4H-2,7-naphthyridin-3-yl)-4-fluorophenyl]-5-cyanopyridine-2-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H16F2N6O
|
||||||||||||||||||
| Molecular Weight |
418.407
|
||||||||||||||||||
| Canonical SMILES |
CC1(Cc2c(F)cncc2C(N)=N1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H16F2N6O/c1-22(7-14-15(20(26)30-22)10-27-11-18(14)24)16-6-13(3-4-17(16)23)29-21(31)19-5-2-12(8-25)9-28-19/h2-6,9-11H,7H2,1H3,(H2,26,30)(H,29,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CHSCSEXKGPIJCF-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