General Information of the Compound
| Compound ID |
CP0299248
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-((1-(benzo[d][1,3]dioxol-5-ylmethyl)piperidin-4-yl)methyl)-N-(1-phenylpropyl)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H34N2O3
|
||||||||||||||||||
| Molecular Weight |
470.613
|
||||||||||||||||||
| Canonical SMILES |
CCC(NC(=O)c1ccc(CC2CCN(Cc3ccc4OCOc4c3)CC2)cc1)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H34N2O3/c1-2-27(25-6-4-3-5-7-25)31-30(33)26-11-8-22(9-12-26)18-23-14-16-32(17-15-23)20-24-10-13-28-29(19-24)35-21-34-28/h3-13,19,23,27H,2,14-18,20-21H2,1H3,(H,31,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
QCPXRXKBSRYKGN-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