General Information of the Compound
| Compound ID |
CP0531046
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(E)-1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(3-morpholin-4-ylphenyl)prop-2-en-1-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H23NO5
|
||||||||||||||||||
| Molecular Weight |
369.417
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(O)c(C(=O)\C=C\c2cccc(c2)N2CCOCC2)c(OC)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H23NO5/c1-25-17-13-19(24)21(20(14-17)26-2)18(23)7-6-15-4-3-5-16(12-15)22-8-10-27-11-9-22/h3-7,12-14,24H,8-11H2,1-2H3/b7-6+
Show/Hide
|
||||||||||||||||||
| InChIKey |
IWIOWTWLOWFTPW-VOTSOKGWSA-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