General Information of the Compound
| Compound ID |
CP0154852
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(5-Cyclohexyl-2-methoxyphenyl)-4-methyl-3-(3-(2-(methylamino)pyrimidin-4-yl)pyridin-2-yloxy)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C31H33N5O3
|
||||||||||||||||||
| Molecular Weight |
523.637
|
||||||||||||||||||
| Canonical SMILES |
CNc1nccc(n1)-c1cccnc1Oc1cc(ccc1C)C(=O)Nc1cc(ccc1OC)C1CCCCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C31H33N5O3/c1-20-11-12-23(29(37)35-26-18-22(13-14-27(26)38-3)21-8-5-4-6-9-21)19-28(20)39-30-24(10-7-16-33-30)25-15-17-34-31(32-2)36-25/h7,10-19,21H,4-6,8-9H2,1-3H3,(H,35,37)(H,32,34,36)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KGUBPBXMEHAZKB-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