General Property |
Molceule ID (DB) | EGIN0000772 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 69 compound |
IUPAC Name | N-(3,5-dibromophenyl)-6,7-dimethoxyquinazolin-4-amine |
Formula | C16H13Br2N3O2 |
Mass | 439.101 |
Exact Mass | 436.937452 |
Composition | C (43.76%), H (2.98%), Br (36.39%), N (9.57%), O (7.29%) |
Atom Count | 36 |
PI | 10.12 |
Smiles | c12c(cc(c(c1)OC)OC)ncnc2Nc1cc(cc(c1)Br)Br |
InChI | 1S/C16H13Br2N3O2/c1-22-14-6-12-13(7-15(14)23-2)19-8-20-16(12)21-11-4-9(17)3-10(18)5-11/h3-8H,1-2H3,(
H,19,20,21) |
InChIKey | HAHWLTAMVXUGEZ-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 | 8568816 |
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 |
5328232
|
Drug Bank Link | - |
ChemSpider Link | 4485397 |
ChEMBL Link | CHEMBL92709 |