General Information of the Compound
| Compound ID |
CP0568412
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
methyl (2E)-2-[2-[[3-[[3,5-bis(trifluoromethyl)phenyl]methoxy]phenoxy]methyl]phenyl]-2-methoxyiminoacetate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H21F6NO5
|
||||||||||||||||||
| Molecular Weight |
541.444
|
||||||||||||||||||
| Canonical SMILES |
CO\N=C(\C(=O)OC)c1ccccc1COc1cccc(OCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H21F6NO5/c1-35-24(34)23(33-36-2)22-9-4-3-6-17(22)15-38-21-8-5-7-20(13-21)37-14-16-10-18(25(27,28)29)12-19(11-16)26(30,31)32/h3-13H,14-15H2,1-2H3/b33-23+
Show/Hide
|
||||||||||||||||||
| InChIKey |
GHMFFXDUMGFNFN-GZZLJNBRSA-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