General Information of the Compound
| Compound ID |
CP0385605
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[5-[1-[(4-aminophenyl)methyl]piperidin-4-yl]-2-propan-2-yloxyphenyl]benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H33N3O2
|
||||||||||||||||||
| Molecular Weight |
443.591
|
||||||||||||||||||
| Canonical SMILES |
CC(C)Oc1ccc(cc1NC(=O)c1ccccc1)C1CCN(Cc2ccc(N)cc2)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H33N3O2/c1-20(2)33-27-13-10-24(18-26(27)30-28(32)23-6-4-3-5-7-23)22-14-16-31(17-15-22)19-21-8-11-25(29)12-9-21/h3-13,18,20,22H,14-17,19,29H2,1-2H3,(H,30,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SCYCEYBZOOCJHQ-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