General Information of the Compound
| Compound ID |
CP0521184
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2-butylbenzofuran-3-yl)(3-ethyl-4-(2-(ethylamino)ethoxy)-5-iodophenyl)methanone
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H30INO3
|
||||||||||||||||||
| Molecular Weight |
519.423
|
||||||||||||||||||
| Canonical SMILES |
CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCNCC)c(CC)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H30INO3/c1-4-7-11-22-23(19-10-8-9-12-21(19)30-22)24(28)18-15-17(5-2)25(20(26)16-18)29-14-13-27-6-3/h8-10,12,15-16,27H,4-7,11,13-14H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
MIHWNDZQGFGAGU-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