General Information of the Compound
| Compound ID |
CP0400352
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[1-[3-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)propyl]piperidin-4-yl]propanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H28FN3O2
|
||||||||||||||||||
| Molecular Weight |
361.461
|
||||||||||||||||||
| Canonical SMILES |
CCC(=O)NC1CCN(CCCN2C(=O)CCc3cccc(F)c23)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H28FN3O2/c1-2-18(25)22-16-9-13-23(14-10-16)11-4-12-24-19(26)8-7-15-5-3-6-17(21)20(15)24/h3,5-6,16H,2,4,7-14H2,1H3,(H,22,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
PUSOKKSBOOFDFO-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