General Information of the Compound
| Compound ID |
CP0421727
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
ethyl 6,8-dimethoxy-4-[4-(2-methoxyphenyl)piperazin-1-yl]quinoline-3-carboxylate
Show/Hide
|
||||||||||||||||||
| Formula |
C25H29N3O5
|
||||||||||||||||||
| Molecular Weight |
451.523
|
||||||||||||||||||
| Canonical SMILES |
CCOC(=O)c1cnc2c(OC)cc(OC)cc2c1N1CCN(CC1)c1ccccc1OC
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H29N3O5/c1-5-33-25(29)19-16-26-23-18(14-17(30-2)15-22(23)32-4)24(19)28-12-10-27(11-13-28)20-8-6-7-9-21(20)31-3/h6-9,14-16H,5,10-13H2,1-4H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
UEFYILRBDOWLPK-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 | |||||||||||||||||||
| 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