General Information of the Compound
| Compound ID |
CP0563666
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[4-[2-[[2-(dimethylamino)acetyl]amino]pyridin-4-yl]oxyphenyl]-3-(4-fluorophenyl)-2,4-dioxo-1-propan-2-ylpyrimidine-5-carboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C29H29FN6O5
|
||||||||||||||||||
| Molecular Weight |
560.586
|
||||||||||||||||||
| Canonical SMILES |
CC(C)n1cc(C(=O)Nc2ccc(Oc3ccnc(NC(=O)CN(C)C)c3)cc2)c(=O)n(-c2ccc(F)cc2)c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H29FN6O5/c1-18(2)35-16-24(28(39)36(29(35)40)21-9-5-19(30)6-10-21)27(38)32-20-7-11-22(12-8-20)41-23-13-14-31-25(15-23)33-26(37)17-34(3)4/h5-16,18H,17H2,1-4H3,(H,32,38)(H,31,33,37)
Show/Hide
|
||||||||||||||||||
| InChIKey |
NCYONVSVKQVALR-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