General Information of the Compound
| Compound ID |
CP0500414
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2E,4E)-1-(2-hydroxyphenyl)-5-(4-methoxyphenyl)penta-2,4-dien-1-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H16O3
|
||||||||||||||||||
| Molecular Weight |
280.323
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(\C=C\C=C\C(=O)c2ccccc2O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H16O3/c1-21-15-12-10-14(11-13-15)6-2-4-8-17(19)16-7-3-5-9-18(16)20/h2-13,20H,1H3/b6-2+,8-4+
Show/Hide
|
||||||||||||||||||
| InChIKey |
DPPZMBMQSSNDFR-JHMJBTLWSA-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