General Information of the Compound
| Compound ID |
CP0514720
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2-[3-(4-methoxyphenyl)-2-oxo-7-[[4-(trifluoromethyl)pyridin-2-yl]methylamino]quinoxalin-1-yl]ethyl]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H24F3N5O3
|
||||||||||||||||||
| Molecular Weight |
511.504
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)-c1nc2ccc(NCc3cc(ccn3)C(F)(F)F)cc2n(CCNC(C)=O)c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H24F3N5O3/c1-16(35)30-11-12-34-23-14-19(32-15-20-13-18(9-10-31-20)26(27,28)29)5-8-22(23)33-24(25(34)36)17-3-6-21(37-2)7-4-17/h3-10,13-14,32H,11-12,15H2,1-2H3,(H,30,35)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HUYPGJIKHOQUMM-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