General Information of the Compound
| Compound ID |
CP0522119
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(3-phenoxybenzyl)-5-(trifluoromethoxy)indoline-2,3-dione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H14F3NO4
|
||||||||||||||||||
| Molecular Weight |
413.351
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)Oc1ccc2N(Cc3cccc(Oc4ccccc4)c3)C(=O)C(=O)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H14F3NO4/c23-22(24,25)30-17-9-10-19-18(12-17)20(27)21(28)26(19)13-14-5-4-8-16(11-14)29-15-6-2-1-3-7-15/h1-12H,13H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
UJIAYMRAJZOVQI-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