General Information of the Compound
| Compound ID |
CP0261257
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-[4-fluoro-3-(trifluoromethyl)phenyl]-3,3-dimethylpyrrolidine-2,5-dione
Show/Hide
|
||||||||||||||||||
| Formula |
C13H11F4NO2
|
||||||||||||||||||
| Molecular Weight |
289.228
|
||||||||||||||||||
| Canonical SMILES |
CC1(C)CC(=O)N(C1=O)c1ccc(F)c(c1)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C13H11F4NO2/c1-12(2)6-10(19)18(11(12)20)7-3-4-9(14)8(5-7)13(15,16)17/h3-5H,6H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
BOGYBLMSKAQPQH-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 | |||||||||||||||||||
| 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