General Information of the Compound
| Compound ID |
CP0475860
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
8-chloro-6-(6-phenoxypyridin-3-yl)-2-propylisoquinolin-1-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H19ClN2O2
|
||||||||||||||||||
| Molecular Weight |
390.87
|
||||||||||||||||||
| Canonical SMILES |
CCCn1ccc2cc(cc(Cl)c2c1=O)-c1ccc(Oc2ccccc2)nc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H19ClN2O2/c1-2-11-26-12-10-16-13-18(14-20(24)22(16)23(26)27)17-8-9-21(25-15-17)28-19-6-4-3-5-7-19/h3-10,12-15H,2,11H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
YWSLBOQDZCGRSR-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