General Information of the Compound
| Compound ID |
CP0851622
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(4-((6,7-Dimethoxyquinolin-4-yl)oxy)phenyl)-2-(1-isopropyl-1H-pyrazol-4-yl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H26N4O4
|
||||||||||||||||||
| Molecular Weight |
446.507
|
||||||||||||||||||
| Canonical SMILES |
COc1cc2nccc(Oc3ccc(NC(=O)Cc4cnn(C(C)C)c4)cc3)c2cc1OC
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H26N4O4/c1-16(2)29-15-17(14-27-29)11-25(30)28-18-5-7-19(8-6-18)33-22-9-10-26-21-13-24(32-4)23(31-3)12-20(21)22/h5-10,12-16H,11H2,1-4H3,(H,28,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
RCDUJLMBGXXBBJ-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
Protein ID: PT00888, Mast/stem cell growth factor receptor Kit
Protein ID: PT00864, Vascular endothelial growth factor receptor 2