General Property |
Molceule ID (DB) | EGIN0001551 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 17 compound |
IUPAC Name | N-(3-bromophenyl)-1H-[1,2,3]triazolo[4,5-g]quinazolin-8-amine |
Formula | C14H9BrN6 |
Mass | 341.165 |
Exact Mass | 340.007207 |
Composition | C (49.29%), H (2.66%), Br (23.42%), N (24.63%) |
Atom Count | 30 |
PI | 5.75 |
Smiles | c12c(cc3c(c1)[nH]nn3)ncnc2Nc1cccc(c1)Br |
InChI | 1S/C14H9BrN6/c15-8-2-1-3-9(4-8)18-14-10-5-12-13(20-21-19-12)6-11(10)16-7-17-14/h1-7H,(H,16,17,18)(H,
19,20,21) |
InChIKey | VICIYGAOMIRRLW-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 | 8632415 |
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 |
6419347
|
Drug Bank Link | - |
ChemSpider Link | 4925153 |
ChEMBL Link | CHEMBL172652 |