General Information of the Compound
| Compound ID |
CP0219067
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[3-(4-Methoxy-phenyl)-3-oxo-propenyl]-benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H15NO3
|
||||||||||||||||||
| Molecular Weight |
281.311
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)C(=O)\C=C\c1cccc(c1)C(N)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H15NO3/c1-21-15-8-6-13(7-9-15)16(19)10-5-12-3-2-4-14(11-12)17(18)20/h2-11H,1H3,(H2,18,20)/b10-5+
Show/Hide
|
||||||||||||||||||
| InChIKey |
WGXAQIXVNJOMNH-BJMVGYQFSA-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