General Property |
Molceule ID (DB) | EGIN0002031 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 7i compound |
IUPAC Name | 3-butyl-N-(4-methoxyphenyl)-2-(propan-2-yl)-3H-imidazo[4,5-g]quinazolin-8-amine |
Formula | C23H27N5O |
Mass | 389.4934 |
Exact Mass | 389.2215605 |
Composition | C (70.92%), H (6.99%), N (17.98%), O (4.11%) |
Atom Count | 56 |
PI | 10.99 |
Smiles | c1(nc2cc3c(Nc4ccc(cc4)OC)ncnc3cc2n1CCCC)C(C)C |
InChI | 1S/C23H27N5O/c1-5-6-11-28-21-13-19-18(12-20(21)27-23(28)15(2)3)22(25-14-24-19)26-16-7-9-17(29-4)10-8
-16/h7-10,12-15H,5-6,11H2,1-4H3,(H,24,25,26) |
InChIKey | SXOSLSSSXFMOGT-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0002031.png) | Structure Backbone | ![](./frame/f_EGIN0002031.png) |
|
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 | 18313807 |
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 |
15984355
|
Drug Bank Link | - |
ChemSpider Link | 13115725 |
ChEMBL Link | CHEMBL515600 |