General Information of the Compound
| Compound ID |
CP0504987
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[5-(3-fluorophenyl)-1-(3-phenoxypropyl)indol-3-yl]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H23FN2O2
|
||||||||||||||||||
| Molecular Weight |
402.469
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)Cc1cn(CCCOc2ccccc2)c2ccc(cc12)-c1cccc(F)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H23FN2O2/c26-21-7-4-6-18(14-21)19-10-11-24-23(15-19)20(16-25(27)29)17-28(24)12-5-13-30-22-8-2-1-3-9-22/h1-4,6-11,14-15,17H,5,12-13,16H2,(H2,27,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JEFBQYOHELFIFM-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