General Information of the Compound
| Compound ID |
CP0558355
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(E)-1-(2,6-dimethylphenyl)-5-phenylpent-2-en-1-one
Show/Hide
|
||||||||||||||||||
| Formula |
C19H20O
|
||||||||||||||||||
| Molecular Weight |
264.368
|
||||||||||||||||||
| Canonical SMILES |
Cc1cccc(C)c1C(=O)\C=C\CCc1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H20O/c1-15-9-8-10-16(2)19(15)18(20)14-7-6-13-17-11-4-3-5-12-17/h3-5,7-12,14H,6,13H2,1-2H3/b14-7+
Show/Hide
|
||||||||||||||||||
| InChIKey |
VZEXWHQCEDANGR-VGOFMYFVSA-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