General Information of the Compound
| Compound ID |
CP0425246
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1,2-dimethoxy-3-[(E)-2-(4-methylphenyl)ethenyl]benzene
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H18O2
|
||||||||||||||||||
| Molecular Weight |
254.329
|
||||||||||||||||||
| Canonical SMILES |
COc1cccc(\C=C\c2ccc(C)cc2)c1OC
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H18O2/c1-13-7-9-14(10-8-13)11-12-15-5-4-6-16(18-2)17(15)19-3/h4-12H,1-3H3/b12-11+
Show/Hide
|
||||||||||||||||||
| InChIKey |
LFXMJRNULNIIIK-VAWYXSNFSA-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