General Information of the Compound
| Compound ID |
CP0340522
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2-methyl-5-(7H-purin-6-yl)phenyl]-4-(pyridin-2-ylmethoxy)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H20N6O2
|
||||||||||||||||||
| Molecular Weight |
436.475
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccc(cc1NC(=O)c1ccc(OCc2ccccn2)cc1)-c1ncnc2nc[nH]c12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H20N6O2/c1-16-5-6-18(22-23-24(29-14-27-22)30-15-28-23)12-21(16)31-25(32)17-7-9-20(10-8-17)33-13-19-4-2-3-11-26-19/h2-12,14-15H,13H2,1H3,(H,31,32)(H,27,28,29,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UGRDXUPKHPRFPG-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