General Property |
Molceule ID (DB) | EGIN0001123 |
Inhibitor Class | Pyrimidine |
Molecule Name in Refrence Article | 28 compound |
IUPAC Name | N-[4-(2-phenoxyethoxy)phenyl]benzo[g]quinolin-4-amine |
Formula | C27H22N2O2 |
Mass | 406.4758 |
Exact Mass | 406.168128 |
Composition | C (79.78%), H (5.46%), N (6.89%), O (7.87%) |
Atom Count | 53 |
PI | 13.56 |
Smiles | c12c(cccc1)cc1c(c2)c(ccn1)Nc1ccc(cc1)OCCOc1ccccc1 |
InChI | 1S/C27H22N2O2/c1-2-8-23(9-3-1)30-16-17-31-24-12-10-22(11-13-24)29-26-14-15-28-27-19-21-7-5-4-6-20(21
)18-25(26)27/h1-15,18-19H,16-17H2,(H,28,29) |
InChIKey | NSCLEKFKAKFKGX-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
|
View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 18500794 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
1718804
|
Drug Bank Link | - |
ChemSpider Link | 1365704 |
ChEMBL Link | CHEMBL486081 |