General Information of the Compound
| Compound ID |
CP0486211
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(2,6-difluorophenyl)-4-[4-[(6-methoxyquinazolin-4-yl)amino]-2-methylphenoxy]piperidine-1-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H27F2N5O3
|
||||||||||||||||||
| Molecular Weight |
519.552
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc2ncnc(Nc3ccc(OC4CCN(CC4)C(=O)Nc4c(F)cccc4F)c(C)c3)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H27F2N5O3/c1-17-14-18(33-27-21-15-20(37-2)7-8-24(21)31-16-32-27)6-9-25(17)38-19-10-12-35(13-11-19)28(36)34-26-22(29)4-3-5-23(26)30/h3-9,14-16,19H,10-13H2,1-2H3,(H,34,36)(H,31,32,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FYJXVEUHAIFPHG-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