General Property |
Molceule ID (DB) | EGIN0001957 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 7b compound |
IUPAC Name | 6,7-diethoxy-4-[(1E)-4-phenylbut-1-en-1-yl]quinazoline |
Formula | C22H24N2O2 |
Mass | 348.4382 |
Exact Mass | 348.183778 |
Composition | C (75.83%), H (6.94%), N (8.04%), O (9.18%) |
Atom Count | 50 |
PI | No isoelectric point. |
Smiles | c1(c(cc2c(c1)c(ncn2)/C=C/CCc1ccccc1)OCC)OCC |
InChI | 1S/C22H24N2O2/c1-3-25-21-14-18-19(13-9-8-12-17-10-6-5-7-11-17)23-16-24-20(18)15-22(21)26-4-2/h5-7,9-
11,13-16H,3-4,8,12H2,1-2H3/b13-9+ |
InChIKey | TYVCCOFEERYUGD-UKTHLTGXSA-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 | 17869510 |
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 |
44442182
|
Drug Bank Link | - |
ChemSpider Link | 23306770 |
ChEMBL Link | CHEMBL399371 |