General Information of the Compound
Compound ID |
CP0257424
|
||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Compound Name |
1-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-3-methoxy-2-methylpyridin-4-one
Show/Hide
|
||||||||||||||||||
Formula |
C23H30N2O3
|
||||||||||||||||||
Molecular Weight |
382.504
|
||||||||||||||||||
Canonical SMILES |
COc1c(C)n(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCCC2)cc1
Show/Hide
|
||||||||||||||||||
InChI |
InChI=1S/C23H30N2O3/c1-17-23(27-2)22(26)13-16-25(17)19-7-9-20(10-8-19)28-21-11-14-24(15-12-21)18-5-3-4-6-18/h7-10,13,16,18,21H,3-6,11-12,14-15H2,1-2H3
Show/Hide
|
||||||||||||||||||
InChIKey |
PUWSNKHMQWHDGJ-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 | |||||||||||||||||||
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