General Information of the Compound
| Compound ID |
CP0413528
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(3,4-difluorobenzoyl)-9b-(3-methoxy-4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H20F2N2O3
|
||||||||||||||||||
| Molecular Weight |
434.442
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(ccc1C)C12N(CCN1C(=O)c1ccccc21)C(=O)c1ccc(F)c(F)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H20F2N2O3/c1-15-7-9-17(14-22(15)32-2)25-19-6-4-3-5-18(19)24(31)29(25)12-11-28(25)23(30)16-8-10-20(26)21(27)13-16/h3-10,13-14H,11-12H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
QAGGNPYLFUGTSS-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