General Information of the Compound
| Compound ID |
CP0486535
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[(3-fluoropyridin-2-yl)methoxy]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
Show/Hide
|
||||||||||||||||||
| Formula |
C20H18FN3O4
|
||||||||||||||||||
| Molecular Weight |
383.379
|
||||||||||||||||||
| Canonical SMILES |
COc1cc2CCn3c(cc(OCc4ncccc4F)nc3=O)-c2cc1OC
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H18FN3O4/c1-26-17-8-12-5-7-24-16(13(12)9-18(17)27-2)10-19(23-20(24)25)28-11-15-14(21)4-3-6-22-15/h3-4,6,8-10H,5,7,11H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
CYSFZDOQCLRCAP-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 | |||||||||||||||||||
| 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