General Information of the Compound
| Compound ID |
CP0533448
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(4-(4-chlorophenyl)piperidin-1-yl)-2-(pyridin-4-ylmethoxy)ethanone
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H21ClN2O2
|
||||||||||||||||||
| Molecular Weight |
344.842
|
||||||||||||||||||
| Canonical SMILES |
Clc1ccc(cc1)C1CCN(CC1)C(=O)COCc1ccncc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H21ClN2O2/c20-18-3-1-16(2-4-18)17-7-11-22(12-8-17)19(23)14-24-13-15-5-9-21-10-6-15/h1-6,9-10,17H,7-8,11-14H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZOSAZOVQKDMFEH-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