General Information of the Compound
| Compound ID |
CP0480053
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(E)-1-(3-methoxyphenyl)-3-[4-[(E)-3-(3-methoxyphenyl)-3-oxoprop-1-enyl]phenyl]prop-2-en-1-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H22O4
|
||||||||||||||||||
| Molecular Weight |
398.458
|
||||||||||||||||||
| Canonical SMILES |
COc1cccc(c1)C(=O)\C=C\c1ccc(\C=C\C(=O)c2cccc(OC)c2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H22O4/c1-29-23-7-3-5-21(17-23)25(27)15-13-19-9-11-20(12-10-19)14-16-26(28)22-6-4-8-24(18-22)30-2/h3-18H,1-2H3/b15-13+,16-14+
Show/Hide
|
||||||||||||||||||
| InChIKey |
CBSARZPLOQEWTN-WXUKJITCSA-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