General Information of the Compound
| Compound ID |
CP0572121
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(5-cyano-4-propan-2-yloxypyridin-2-yl)-7-formyl-6-[[methyl(methylsulfonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H26N6O5S
|
||||||||||||||||||
| Molecular Weight |
486.554
|
||||||||||||||||||
| Canonical SMILES |
CC(C)Oc1cc(NC(=O)N2CCCc3cc(CN(C)S(C)(=O)=O)c(C=O)nc23)ncc1C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H26N6O5S/c1-14(2)33-19-9-20(24-11-17(19)10-23)26-22(30)28-7-5-6-15-8-16(12-27(3)34(4,31)32)18(13-29)25-21(15)28/h8-9,11,13-14H,5-7,12H2,1-4H3,(H,24,26,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
QHHNXXQTDZYPIK-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