General Information of the Compound
| Compound ID |
CP0408638
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[[5-(cyclohexylmethoxy)-4-oxochromen-3-yl]methyl]-N-(2-hydroxyethyl)-2-(4-methoxyphenyl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H33NO6
|
||||||||||||||||||
| Molecular Weight |
479.573
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(CC(=O)N(CCO)Cc2coc3cccc(OCC4CCCCC4)c3c2=O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H33NO6/c1-33-23-12-10-20(11-13-23)16-26(31)29(14-15-30)17-22-19-35-25-9-5-8-24(27(25)28(22)32)34-18-21-6-3-2-4-7-21/h5,8-13,19,21,30H,2-4,6-7,14-18H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
OZDXUAORYIQFSL-UHFFFAOYSA-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