General Information of the Compound
| Compound ID |
CP0364260
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[4-[8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]propanenitrile
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H17N5
|
||||||||||||||||||
| Molecular Weight |
399.457
|
||||||||||||||||||
| Canonical SMILES |
CC(C#N)c1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H17N5/c1-18(14-27)21-7-9-22(10-8-21)31-17-30-25-16-29-24-11-6-19(13-23(24)26(25)31)4-5-20-3-2-12-28-15-20/h2-3,6-13,15-18H,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
JPILNANJKLSYFG-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