General Information of the Compound
| Compound ID |
CP0384270
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[[4-[(benzylamino)methyl]piperidin-1-yl]methyl]phenol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H26N2O
|
||||||||||||||||||
| Molecular Weight |
310.441
|
||||||||||||||||||
| Canonical SMILES |
Oc1ccc(CN2CCC(CNCc3ccccc3)CC2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H26N2O/c23-20-8-6-19(7-9-20)16-22-12-10-18(11-13-22)15-21-14-17-4-2-1-3-5-17/h1-9,18,21,23H,10-16H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
DIJFWKULIZOLEH-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