General Information of the Compound
| Compound ID |
CP0573847
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1,3-difluoro-2-[(E)-2-(2-fluorophenyl)ethenyl]benzene
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H9F3
|
||||||||||||||||||
| Molecular Weight |
234.22
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccccc1\C=C\c1c(F)cccc1F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H9F3/c15-12-5-2-1-4-10(12)8-9-11-13(16)6-3-7-14(11)17/h1-9H/b9-8+
Show/Hide
|
||||||||||||||||||
| InChIKey |
KVQMRXAKYBRTLB-CMDGGOBGSA-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