General Information of the Compound
| Compound ID |
CP0542096
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
ethyl 6-(3,5-dichloro-4-hydroxyphenyl)-4-[(1-methylpiperidin-4-yl)amino]-1,5-naphthyridine-3-carboxylate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H24Cl2N4O3
|
||||||||||||||||||
| Molecular Weight |
475.376
|
||||||||||||||||||
| Canonical SMILES |
CCOC(=O)c1cnc2ccc(nc2c1NC1CCN(C)CC1)-c1cc(Cl)c(O)c(Cl)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H24Cl2N4O3/c1-3-32-23(31)15-12-26-19-5-4-18(13-10-16(24)22(30)17(25)11-13)28-21(19)20(15)27-14-6-8-29(2)9-7-14/h4-5,10-12,14,30H,3,6-9H2,1-2H3,(H,26,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
WBMRWOHWNXIYLL-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