General Information of the Compound
| Compound ID |
CP0385250
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
7-[4-chloro-2-[2-(2,4-dioxopyrimidin-1-yl)ethoxy]phenoxy]-5-fluoro-8-methylnaphthalene-2-carbonitrile
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H17ClFN3O4
|
||||||||||||||||||
| Molecular Weight |
465.868
|
||||||||||||||||||
| Canonical SMILES |
Cc1c(Oc2ccc(Cl)cc2OCCn2ccc(=O)[nH]c2=O)cc(F)c2ccc(cc12)C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H17ClFN3O4/c1-14-18-10-15(13-27)2-4-17(18)19(26)12-21(14)33-20-5-3-16(25)11-22(20)32-9-8-29-7-6-23(30)28-24(29)31/h2-7,10-12H,8-9H2,1H3,(H,28,30,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UJZCDCFTLLMXQV-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