General Information of the Compound
| Compound ID |
CP0427843
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
Morpholino-ethyl analogue, 43
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H33N3O4S
|
||||||||||||||||||
| Molecular Weight |
447.601
|
||||||||||||||||||
| Canonical SMILES |
CC1(C)C(C(=O)c2cn(CCN3CCOCC3)c3cccc(NS(C)(=O)=O)c23)C1(C)C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H33N3O4S/c1-22(2)21(23(22,3)4)20(27)16-15-26(10-9-25-11-13-30-14-12-25)18-8-6-7-17(19(16)18)24-31(5,28)29/h6-8,15,21,24H,9-14H2,1-5H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
IMVPJCWCKUNHSI-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