General Information of the Compound
| Compound ID |
CP0506059
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[3-chloro-4-(4-piperidin-1-ylpiperidin-1-yl)phenyl]-2-methyl-2-(3-methylphenyl)propanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H36ClN3O
|
||||||||||||||||||
| Molecular Weight |
454.058
|
||||||||||||||||||
| Canonical SMILES |
Cc1cccc(c1)C(C)(C)C(=O)Nc1ccc(N2CCC(CC2)N2CCCCC2)c(Cl)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H36ClN3O/c1-20-8-7-9-21(18-20)27(2,3)26(32)29-22-10-11-25(24(28)19-22)31-16-12-23(13-17-31)30-14-5-4-6-15-30/h7-11,18-19,23H,4-6,12-17H2,1-3H3,(H,29,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
MYFUPUVJZDTVAD-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