General Information of the Compound
| Compound ID |
CP0557695
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[2-(5-methoxy-1-pyridin-4-ylbenzimidazol-2-yl)ethyl]-1-methylimidazo[4,5-b]pyridin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H20N6O2
|
||||||||||||||||||
| Molecular Weight |
400.442
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc2n(c(CCn3c4ncccc4n(C)c3=O)nc2c1)-c1ccncc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H20N6O2/c1-26-19-4-3-10-24-21(19)27(22(26)29)13-9-20-25-17-14-16(30-2)5-6-18(17)28(20)15-7-11-23-12-8-15/h3-8,10-12,14H,9,13H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
PHYXJHKCBIMCKJ-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