General Information of the Compound
| Compound ID |
CP0489756
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(4-bromophenyl)-5-[2-(oxan-4-yl)ethyl]imidazo[2,1-a]isoindole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H23BrN2O
|
||||||||||||||||||
| Molecular Weight |
423.354
|
||||||||||||||||||
| Canonical SMILES |
Brc1ccc(cc1)C1(CCC2CCOCC2)c2ccccc2-c2nccn12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H23BrN2O/c24-19-7-5-18(6-8-19)23(12-9-17-10-15-27-16-11-17)21-4-2-1-3-20(21)22-25-13-14-26(22)23/h1-8,13-14,17H,9-12,15-16H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
XPRHNWSRKLFWHX-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