General Information of the Compound
| Compound ID |
CP0272481
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-(4-fluorophenyl)-N-[2-[4-[[4-(2-oxopropylamino)piperidin-1-yl]methyl]phenyl]ethyl]benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H34FN3O2
|
||||||||||||||||||
| Molecular Weight |
487.619
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)CNC1CCN(Cc2ccc(CCNC(=O)c3ccc(cc3)-c3ccc(F)cc3)cc2)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H34FN3O2/c1-22(35)20-33-29-15-18-34(19-16-29)21-24-4-2-23(3-5-24)14-17-32-30(36)27-8-6-25(7-9-27)26-10-12-28(31)13-11-26/h2-13,29,33H,14-21H2,1H3,(H,32,36)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ARFXECJNWZZFLK-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