General Information of the Compound
| Compound ID |
CP0495083
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(3,5-Dimethoxy-phenyl)-N-[1-(3,3-diphenyl-propyl)-piperidin-4-yl]-N-methyl-acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C31H38N2O3
|
||||||||||||||||||
| Molecular Weight |
486.656
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(CC(=O)N(C)C2CCN(CCC(c3ccccc3)c3ccccc3)CC2)cc(OC)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C31H38N2O3/c1-32(31(34)22-24-20-28(35-2)23-29(21-24)36-3)27-14-17-33(18-15-27)19-16-30(25-10-6-4-7-11-25)26-12-8-5-9-13-26/h4-13,20-21,23,27,30H,14-19,22H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
BSFZNSGCHHTBRI-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